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Shanghai Sochem International Co., Ltd.

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Contact: Mr.John Xu
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Profile: Shanghai Sochem International Co., Ltd. is a manufacture of dyestuffs, pharmaceutical intermediates, pesticide intermediates, dyestuff intermediates, pigments and speciality chemicals. Our agrochemical & intermediates include 2,4-D isooctyl ester, aluminium phosphide, benzyl chloroformate, bromopropylate, campholenic aldehyde and copper acetate. Our speciality chemicals are photoinitiators, UV absorbers, water treatment chemicals, flame retardants and biochemicals.

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• 1,3,4,5-Tetrachloro-2,6-Dicyanobenzene
IUPAC Name: 2,4,5,6-tetrachlorobenzene-1,3-dicarbonitrile | CAS Registry Number: 1897-45-6
Synonyms: Daconil, CHLOROTHALONIL, Bravo, Chloroalonil, Terraclactyl, Clortosip, Dacosoil, Exotherm, Nopcocide, Forturf, Repulse, Termil, Faber, Sweep, Exotherm termil, m-Tcpn, Clortocaf ramato, Daconil Flowable, meta-TCPN, Chlorothanonil

Molecular Formula: C8Cl4N2Molecular Weight: 265.911000 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: CRQQGFGUEAVUIL-UHFFFAOYSA-N

• 1,5-Di-(2,4-dimethylphenyl)-3-methyl-1,3,5-triazapenta-1,4-diene
IUPAC Name: N'-(2,4-dimethylphenyl)-N-[(2,4-dimethylphenyl)iminomethyl]-N-methylmethanimidamide | CAS Registry Number: 33089-61-1
Synonyms: AMITRAZ, Mitac, Mitaban, Triazid, Taktic, Azadieno, Azaform, Ectodex, Edrizar, Acarac, Bipin, Amitraz estrella, Fumilat A, BAAM, Amitraze [French], Mitaban (Veterinary), Caswell No. 374A, Amitrazum [INN-Latin], Upjohn U-36059, Amitraz (USP/INN)

Molecular Formula: C19H23N3Molecular Weight: 293.406020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: QXAITBQSYVNQDR-UHFFFAOYSA-N

• 1-H 1,2,4-Ltriazole Sodium Salt
IUPAC Name: sodium 2,4-diaza-5-azanidacyclopenta-1,3-diene | CAS Registry Number: 41253-21-8
Synonyms: 1,2,4-Triazole sodium salt, Sodium-1,2-4-triazolide, Sodium 1H-1,2,4-triazolate, Sodium 1H-1,2,4-triazolide, 1,2,4-Triazole, sodium salt, MLS001335997, MLS001335998, 1,2,4-Triazole sodium derivative, 197645_ALDRICH, sodium 1,2,4-triazol-1-ide, 1H-1,2,4-Triazole, sodium salt, EINECS 255-280-9, NCGC00090960-01, SMR000857331, LS-195501, TL8006523, 1H-1,2,4-Triazole, sodium salt (1:1), 117547-14-5

Molecular Formula: C2H2N3NaMolecular Weight: 91.047150 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: NVMNEWNGLGACBB-UHFFFAOYSA-N

• 1H-Benzimidazol-2-Ylcarbamic Acid Methyl Ester
IUPAC Name: methyl N-(1H-benzimidazol-2-yl)carbamate | CAS Registry Number: 10605-21-7
Synonyms: Carbendazim, Carbendazole, Mecarzole, Carbendazime, Carbendazol, Bavistin, Thicoper, Derosal, Funaben, Carbendazym, Equitdazin, Falicarben, Pillarstin, Supercarb, Bavistan, Fungisol, Garbenda, Kemdazin, Medamine, Triticol

Molecular Formula: C9H9N3O2Molecular Weight: 191.186660 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: TWFZGCMQGLPBSX-UHFFFAOYSA-N

• 1-Naphthyl-N-Methylcarbamate
IUPAC Name: naphthalen-1-yl N-methylcarbamate | CAS Registry Number: 63-25-2
Synonyms: Carbaril, Sevin, CARBARYL, Karbaspray, Carylderm, Menaphtam, Tricarnam, Caprolin, Carbatox, Carbavur, Carpolin, Dicarbam, Karbatox, Karbosep, Arilate, Denapon, Gamonil, Hexavin, Seffein, Septene

Molecular Formula: C12H11NO2Molecular Weight: 201.221240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CVXBEEMKQHEXEN-UHFFFAOYSA-N

• 1-Tert-Butyl-2-(4-Chlorobenzyl)-2-(1,2,4-Triazol-1-Yl)-Ethanol
IUPAC Name: (3R)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol; (3S)-1-(4-chlorophenyl)-4,4-dimethyl-2-(1,2,4-triazol-1-yl)pentan-3-ol | CAS Registry Number: 76738-62-0
Synonyms: Paclobutrazol, Friazole, Clipper, Trimmit, Cultar, Parlay, Bonzi, Duo Xiao Zuo, Clipper 50WP, Caswell No. 628C, ICI-PP 333, Paclobutrazol [ANSI:BSI:ISO], EINECS 266-325-7, PP 333, EPA Pesticide Chemical Code 125601, LS-155977, alpha-tert-Butyl-beta-((4-chlorophenyl)methyl)-1H-triazol-1-ethanol, (2RS,3RS)-1-(4-Chlorophenyl)-4,4-dimethyl-2-(1H-1,2,4-triazol-1-yl)pentan-3-ol, (2RS,3RS)-1-(4-Chlorophenyl)-4,4-dimethyl-2-1,2,4-triazol-1-yl pentan-3-ol, beta-((4-Chlorophenyl)methyl)-alpha-(1,1-dimethylethyl)-1H-1,2,4-triazole-1-ethanol

Molecular Formula: C30H40Cl2N6O2Molecular Weight: 587.583600 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 8

InChIKey: GHGCUYKTGPFCTK-LZOIJMLOSA-N

• 2,4-Dichloro-3,5-Dinitrobenzotrifluoride
IUPAC Name: 2,4-dichloro-1,3-dinitro-5-(trifluoromethyl)benzene | CAS Registry Number: 29091-09-6
Synonyms: ZINC02168652, CID94398, EINECS 249-420-8, 2,4-Dichloro-1,3-dinitro-5-(trifluoromethyl)benzene, Benzene, 2,4-dichloro-1,3-dinitro-5-(trifluoromethyl)-

Molecular Formula: C7HCl2F3N2O4Molecular Weight: 304.995050 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: DPQYRXNRGNLPFC-UHFFFAOYSA-N

• 2,2-Dichlorovinyl Dimethyl Phosphate (DDVP)
IUPAC Name: 2,2-dichloroethenyl dimethyl phosphate | CAS Registry Number: 62-73-7
Synonyms: dichlorvos, Dichlorphos, Dichlorophos, Divipan, Atgard, Vapona, Chlorvinphos, Dichlorman, Dichlorovos, Lindanmafu, Szklarniak, Vinylophos, Winylophos, Krecalvin, Vinylofos, Brevinyl, Canogard, Equigard, Estrosel, Vaponite

Molecular Formula: C4H7Cl2O4PMolecular Weight: 220.975741 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OEBRKCOSUFCWJD-UHFFFAOYSA-N

• 2,3-Dihydro-2,2-Dimethyl-7-Benzofuranol Methylcarbamate
IUPAC Name: (2,2-dimethyl-3H-1-benzofuran-7-yl) N-methylcarbamate | CAS Registry Number: 1563-66-2
Synonyms: carbofuran, Furadan, Curaterr, Yaltox, Carbofurane, Pillarfuran, Crisfuran, Kenofuran, Chinufur, Furacarb, Brifur, Furadan 3G, Furodan, Furadan G, Furadan 4f, Karbofuranu [Polish], Niagara 10242, Caswell No. 160A, Niagara nia-10242, Spectrum_001895

Molecular Formula: C12H15NO3Molecular Weight: 221.252400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DUEPRVBVGDRKAG-UHFFFAOYSA-N

• 2,3-Dimethyl-4-Nitropyridine-N-Oxide
IUPAC Name: 2,3-dimethyl-4-nitro-1-oxidopyridin-1-ium | CAS Registry Number: 37699-43-7
Synonyms: 559849_ALDRICH, 4-Nitro-2,3-lutidine-N-oxide, 2,3-Dimethyl-4-nitropyridine 1-oxide, BRN 1569438, ZINC04831092, 4-Nitro-2,3-dimethylpyridine N-oxide, Pyridine, 2,3-dimethyl-4-nitro-, 1-oxide, LS-131487, ST5408449, TL8002771

Molecular Formula: C7H8N2O3Molecular Weight: 168.150020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: CFMTVTYBZMKULI-UHFFFAOYSA-N

• 2,4,6-Tribromophenol
IUPAC Name: 2,4,6-tribromophenol | CAS Registry Number: 118-79-6
Synonyms: 2,4,6-tribromophenol, Tribromophenol, Bromkal pur 3, Bromol, Xeroform, Flammex 3BP, Phenol, 2,4,6-tribromo-, 1e5a, C6H3Br3O, BISMUTH TRIBROMOPHENATE, WLN: QR BE DE FE, CCRIS 1658, TA 10, HSDB 5584, MLS002152858, 137715_ALDRICH, 36918_RIEDEL, 442304_SUPELCO, NSC 2136, 90730_FLUKA

Molecular Formula: C6H3Br3OMolecular Weight: 330.799420 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BSWWXRFVMJHFBN-UHFFFAOYSA-N

• 2,5-Dimethylphenol
IUPAC Name: 2,5-dimethylphenol | CAS Registry Number: 95-87-4
Synonyms: p-Xylenol, 2,5-Xylenol, 6-Methyl-m-cresol, Phenol, 2,5-dimethyl-, 2,5-DIMETHYLPHENOL, 3,6-Dimethylphenol, 3,6-Xylenol, 2,5-Dimethyl phenol, 1,2,5-Xylenol, 2-Hydroxy-p-xylene, 2,5-Dmp, 1-Hydroxy-2,5-dimethylbenzene, CCRIS 722, FEMA No. 3595, 1,4-Dimethyl-2-hydroxybenzene, HSDB 5296, D174602_ALDRICH, W359505_ALDRICH, WLN: QR B1 E1, 36714_RIEDEL

Molecular Formula: C8H10OMolecular Weight: 122.164400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: NKTOLZVEWDHZMU-UHFFFAOYSA-N

• 2,6-Dichloro-4-Amino Phenol
IUPAC Name: 4-amino-2,6-dichlorophenol | CAS Registry Number: 5930-28-9
Synonyms: 2,6-Dichloro-p-aminophenol, 4-Amino-2,6-dichlorophenol, 2,6-Dichloro-4-aminophenol, Phenol, 4-amino-2,6-dichloro-, 3,5-Dichloro-4-hydroxyaniline, A48407_ALDRICH, EINECS 227-671-4, ZINC00157166, NSC 156835, CID80037, NSC156835, SBB003766, 4-AMINO-2,6-DICHLOROPHENOL HCl, NCGC00164211-01, LS-103889, InChI=1/C6H5Cl2NO/c7-4-1-3(9)2-5(8)6(4)10/h1-2,10H,9H, 42486-53-3

Molecular Formula: C6H5Cl2NOMolecular Weight: 178.016000 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: KGEXISHTCZHGFT-UHFFFAOYSA-N

• 2,6-Difluorobenzamide
IUPAC Name: 2,6-difluorobenzamide | CAS Registry Number: 18063-03-1
Synonyms: Benzamide, 2,6-difluoro-, Ambap1714, 282278_ALDRICH, EINECS 241-972-8, ZINC00152949, CID87439, JRD-0429, LS-26492, TL8001442, InChI=1/C7H5F2NO/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H2,10,11

Molecular Formula: C7H5F2NOMolecular Weight: 157.117506 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: AVRQBXVUUXHRMY-UHFFFAOYSA-N

• 2-[(1,1-Dimethylethyl)-Imino]-Tetrehydro-3-(1-Methylethyl)-5-Phenyl-4H-1,3,5-Thiadiazin-4- One
IUPAC Name: 2-tert-butylimino-5-phenyl-3-propan-2-yl-1,3,5-thiadiazinan-4-one | CAS Registry Number: 69327-76-0
Synonyms: Applaud, BUPROFEZIN, Buprofezine, (E)-buprofezin, (Z)-buprofezin, Buprofezin [BSI:ISO], Buprofezine [ISO-French], Buprofezine [ISO-French], NNI 750, 37886_RIEDEL, CHEBI:3218, PP618, CHEBI:39380, CHEBI:39381, CID50367, BRN 1010518, AI3-29749, NCGC00163828-01, NCGC00163828-02, NCGC00163828-03

Molecular Formula: C16H23N3OSMolecular Weight: 305.438320 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: PRLVTUNWOQKEAI-UHFFFAOYSA-N

• 2-Amino-4,6-Dimethoxypyrimidine
IUPAC Name: 4,6-dimethoxypyrimidin-2-amine | CAS Registry Number: 36315-01-2
Synonyms: Maybridge1_002259, 2-Amino-4,6-dimethoxypyrimidine, Oprea1_751622, 375349_ALDRICH, 4,6-Dimethoxypyrimidin-2-amine, 2-Pyrimidinamine, 4,6-dimethoxy-, EINECS 252-969-6, SBB006932, ZINC00132738, SR-01000634114-1

Molecular Formula: C6H9N3O2Molecular Weight: 155.154560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: LVFRCHIUUKWBLR-UHFFFAOYSA-N

• 2-Chloro-2',6'-diethyl-N-(butoxymethyl)acetanilide
IUPAC Name: N-(butoxymethyl)-2-chloro-N-(2,6-diethylphenyl)acetamide | CAS Registry Number: 23184-66-9
Synonyms: BUTACHLOR, Machete, Machette, Rasayanchlor, Hiltachlor, Pillarsete, Amichlor, Bilchlor, Butaclor, Delchlor, Butanex, Weedout, Mach-Mach, Delchlor 5G, Machete (herbicide), Dow Formula 40, Gormel's Weed Kil, Caswell No. 119B, Home Use Weed Killer, Butachlor [ANSI:BSI:ISO]

Molecular Formula: C17H26ClNO2Molecular Weight: 311.846840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: HKPHPIREJKHECO-UHFFFAOYSA-N

• 2-Hydroxy-2-Methyl-Phenyl-Propane-1-One
IUPAC Name: 2-hydroxy-2-methyl-1-phenylpropan-1-one | CAS Registry Number: 7473-98-5
Synonyms: HMPP, 2-Hydroxy-2-methylpropiophenone, 405655_ALDRICH, EINECS 231-272-0, 1-Phenyl-2-hydroxy-2-methylpropan-1-one, NSC 401744, NSC401744, 1-Propanone, 2-hydroxy-2-methyl-1-phenyl-, 2-Hydroxy-2-methyl-1-phenyl-1-propanone, LS-123055, TL8005139, 126038-32-2, 71833-40-4, 75718-48-8

Molecular Formula: C10H12O2Molecular Weight: 164.201080 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XMLYCEVDHLAQEL-UHFFFAOYSA-N

• 2-Hydroxy-4-Methoxy Benzophenone
IUPAC Name: (2-hydroxy-4-methoxyphenyl)-phenylmethanone | CAS Registry Number: 131-57-7
Synonyms: oxybenzone, Oxybenzon, Benzophenone-3, Anuvex, Oxibenzonum, Solaquin, DuraScreen, Chimassorb 90, Uvinul 9, Advastab 45, Ongrostab HMB, Solbar, Syntase 62, Uvistat 24, Cyasorb UV 9, Sunscreen UV-15, Usaf cy-9, Mixture Name, Spectra-sorb UV 9, Uvinul M40

Molecular Formula: C14H12O3Molecular Weight: 228.243280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: DXGLGDHPHMLXJC-UHFFFAOYSA-N

• 2-Hydroxy-4-Methoxy Benzophenone-5-Sulphonic Acid
IUPAC Name: 5-(benzoyl)-4-hydroxy-2-methoxybenzenesulfonic acid | CAS Registry Number: 4065-45-6
Synonyms: Sulisobenzone, Sungard, Sulisobenzona, Sulisobenzonum, Uvinul, Uval, Benzophenone 4, Benzophenone-4, Uval sodium salt, Uvinuc ms 40, Seesorb 101S, Syntase 230, Uvinul MS 40, UV Absorber HMBS, Sungard (TN), HMBS, SULISOBENZENE, Uvinul MS-40 substanz, Spectra-Sorb UV 284, Uval (*sodium salt*)

Molecular Formula: C14H12O6SMolecular Weight: 308.306480 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 6

InChIKey: CXVGEDCSTKKODG-UHFFFAOYSA-N

• 2-Methyl-3-Acetoxybenzoic Acid
IUPAC Name: 3-acetyloxy-2-methylbenzoic acid | CAS Registry Number: 168899-58-9
Synonyms: 3-Acetoxy-2-methylbenzoic acid, 2-Methyl-3-acetoxybenzoic acid, 3-acetyloxy-2-methylbenzoic acid, SBB063332, AMBA, AC1MXZKZ, ACMC-209dz2, AC1Q1L9V, SureCN6178884, KSC495O2N, 495255_ALDRICH, Jsp003420, CTK3J5726, 3-Acetoxy-2-Methyl-Benzoic Acid, MolPort-001-794-616, AC-594, ANW-22380, 3-(Acetyloxy)-2-methyl-benzoic Acid, AKOS015888713, AB07799

Molecular Formula: C10H10O4Molecular Weight: 194.184000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: LHVJUPHCLWIPLZ-UHFFFAOYSA-N

• 2-Naphthylamine-4,8-Disulphonic Acid (C-Acid)
IUPAC Name: 3-aminonaphthalene-1,5-disulfonic acid | CAS Registry Number: 131-27-1
Synonyms: C acid, Acid IV, Kyselina C, Kyselina C [Czech], 4,8-Disulfo-2-naphthalamine, beta-Naphthylaminedisulfonic acid, 2-Naphthylamine-4,8-disulfonic acid, 3-Amino-1,5-naphthalenedisulfonic acid, Aminonaphthalene disulfonic acid, NSC 7558, EINECS 205-020-5, 2-Amino-4,8-naphthalenedisulfonic acid, 7-Amino-1,5-naphthalenedisulfonic acid, NSC7558, WLN: L66J BSWQ DZ GSWQ, AIDS000371, .beta.-Naphthylaminedisulfonic acid, 1,5-Naphthalenedisulfonic acid, 3-amino-, AIDS-000371, beta-Naphthylamine-4,8-disulfonic acid

Molecular Formula: C10H9NO6S2Molecular Weight: 303.311560 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 7

InChIKey: MTJGVAJYTOXFJH-UHFFFAOYSA-N

• 3-(2,2-Dichloroethenyl)-2,2-Dimethylcyclopropanecarboxylic Acid (3-Phenoxyphenyl)-Methyl Ester
IUPAC Name: [3-(phenoxy)phenyl]methyl (1R,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropane-1-carboxylate | CAS Registry Number: 52645-53-1
Synonyms: Permethrin, Elimite, Permethrine, Ambushfog, Chinetrin, Efmethrin, Imperator, Indothrin, Outflank, Permasect, Perthrine, Pynosect, Stomoxin, Stomozan, Acticin, Corsair, Dragnet, Ecsumin, Ectiban, Kaleait

Molecular Formula: C21H20Cl2O3Molecular Weight: 391.287700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: RLLPVAHGXHCWKJ-HKUYNNGSSA-N

• 3-(4-Cumyl)-1,1-Dimethylurea
IUPAC Name: 1,1-dimethyl-3-(4-propan-2-ylphenyl)urea | CAS Registry Number: 34123-59-6
Synonyms: Graminon, Belgran, Arelon, Tolkan, ISOPROTURON, Nocilon, Arelon R, Alon, Zodiac TX, IPU Stefes, isoproturon-50, IP-Flo, Hytane 500L, Isoproturon solution, Isoproturon [BSI:ISO], PS2000_SUPELCO, 3-p-Cumenyl-1,1-dimethylurea, DPX 6774, 36137_RIEDEL, 45867_RIEDEL

Molecular Formula: C12H18N2OMolecular Weight: 206.284120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: PUIYMUZLKQOUOZ-UHFFFAOYSA-N

• 3,6-Dihydroxypyridazine
IUPAC Name: 1,2-dihydropyridazine-3,6-dione | CAS Registry Number: 123-33-1
Synonyms: Vondalhyde, Antergon, Antyrost, Malazide, Stuntman, Regulox, Vondrax, Malzid, Retard, MALEIC HYDRAZIDE, Sprout/off, Maleic hydrazine, De-sprout, Sucker-Stuff, Super-de-sprout, Sprout-Stop, Burtolin, Chemform, Unriprim, Milurit

Molecular Formula: C4H4N2O2Molecular Weight: 112.086760 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: BGRDGMRNKXEXQD-UHFFFAOYSA-N

• 3,7-Dichloro-8-Quinolinecarboxylic Acid
IUPAC Name: 3,7-dichloroquinoline-8-carboxylic acid | CAS Registry Number: 84087-01-4
Synonyms: Quinclorac, Facet, Quinclorac tech, Quinchlorac, Quinclorac [ISO], 3,7-Dichloroquinoline-8-carboxylic acid, 36521_RIEDEL, BAS 514 00H, BAS 514 H, 3,7-Dichloro-8-quinolinecarboxylic acid, EPA Pesticide Chemical Code 128974, 8-Quinolinecarboxylic acid, 3,7-dichloro-, 3,7 dichloroquinoline-8-carboxylic acid, NCGC00163716-01, NCGC00163716-02, EE4027801, LS-141512, 3,7-Dichloorchinoline-8-carbonzuur [Dutch], 3,7-Dichlorchinolin-8-carbonsaure [Danish], 3,7-Dichlorquinolin-8-carboxylsyre [Danish]

Molecular Formula: C10H5Cl2NO2Molecular Weight: 242.058200 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: FFSSWMQPCJRCRV-UHFFFAOYSA-N

• 3-Hydroxybenzoic Acid
IUPAC Name: 3-hydroxybenzoic acid | CAS Registry Number: 99-06-9
Synonyms: 3-Hydroxybenzoic acid, 3-Carboxyphenol, m-Salicylic acid, M-HYDROXYBENZOIC ACID, m-Hba, Benzoic acid, 3-hydroxy-, Benzoic acid, m-hydroxy-, 3-Hydroxybenzoate, 3pcb, Enamine_005356, H20008_ALDRICH, Acido m-idrossibenzoico [Italian], Kyselina 3-hydroxybenzoova [Czech], 54610_FLUKA, 54620_FLUKA, CHEBI:30764, EINECS 202-726-5, NSC 55746, AIDS018037, AIDS-018037

Molecular Formula: C7H6O3Molecular Weight: 138.120740 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IJFXRHURBJZNAO-UHFFFAOYSA-N

• 4,4,4-Trifluoro-1 (4-Methylphenyl)-Butane-1,3-Dione
IUPAC Name: 4,4,4-trifluoro-1-(4-methylphenyl)butane-1,3-dione | CAS Registry Number: 720-94-5
Synonyms: TOS-BB-0661, ALBB-006417, STK298732, TL8005050, 1,3-Butanedione, 4,4,4-trifluoro-1-p-tolyl-, 4,4,4-trifluoro-1-(4-methylphenyl)butane-1,3-dione, l-(4-Methylphenyl)-4,4,4-trifluorobutane-1,3-dione, Benzene, 1-(3-trifluoromethyl-3-hydroxypropenoyl)-4-methyl-

Molecular Formula: C11H9F3O2Molecular Weight: 230.183170 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: WRZMHTIRFOFFPY-UHFFFAOYSA-N

• 4-Chloro-3,5-Dinitrobenzotrifluoride
IUPAC Name: 2-chloro-1,3-dinitro-5-(trifluoromethyl)benzene | CAS Registry Number: 393-75-9
Synonyms: CDNT, DNT-Cl, CCRIS 2818, NCIOpen2_005439, HSDB 4262, 197017_ALDRICH, 3,5-Dinitro-4-chlorobenzotrifluoride, 4-CHLORO-3,5-DINITROBENZOTRIFLUORIDE, EINECS 206-889-3, TOS-BB-0069, NSC 88274, 2,6-Dinitro-4-trifluoromethylchlorobenzene, 2-Chloro-1,3-dinitro-5-(trifluoromethyl)benzene, NSC88274, Benzene, 2-chloro-1,3-dinitro-5-(trifluoromethyl)-, BRN 1220937, LS-108, Trifluoromethyl-3,5-dinitro-4-chlorobenzene, ZINC02022399, Benzotrifluoride, 4-chloro-3,5-dinitro-

Molecular Formula: C7H2ClF3N2O4Molecular Weight: 270.549990 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 7

InChIKey: HFHAVERNVFNSHL-UHFFFAOYSA-N

• 4-Methylbenzophenone
IUPAC Name: (4-methylphenyl)-phenylmethanone | CAS Registry Number: 134-84-9
Synonyms: p-Benzoyltoluene, p-Methylbenzophenone, Phenyl p-tolyl ketone, 4-Methyl benzophenone, p-Benzophenone, methyl-, BENZOPHENONE, 4-METHYL-, Methanone, (4-methylphenyl)phenyl-, USAF DO-54, WLN: 1R DVR, M29959_ALDRICH, NSC 4898, EINECS 205-159-1, (4-Methyphenyl)(phenyl)methanone, NSC4898, (4-Methylphenyl)(phenyl)methanone, AI3-18452, NCGC00164221-01, LS-38942

Molecular Formula: C14H12OMolecular Weight: 196.244480 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: WXPWZZHELZEVPO-UHFFFAOYSA-N

• 4-Methylmercapto-3-Methylphenyldimethylthiophosphate
IUPAC Name: dimethoxy-(3-methyl-4-methylsulfanylphenoxy)-sulfanylidene-$l^{5}-phosphane | CAS Registry Number: 55-38-9
Synonyms: fenthion, Mercaptophos, Baytex, Lebaycid, Sulfidophos, Fenthione, Phenthion, Queletox, Figuron, Spotton, Talodex, Tiguvon, Baycid, Entex, Fenthion-methyl, Mercaptofos, Bay-Bassa, Lebayeid, Thiophos, Spotten

Molecular Formula: C10H15O3PS2Molecular Weight: 278.328061 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: PNVJTZOFSHSLTO-UHFFFAOYSA-N

• 5-[2-Chloro-4-(Trifluoromethyl)-Phenoxy]-2-Nitrobenzoic Acid
IUPAC Name: 5-[2-chloro-4-(trifluoromethyl)phenoxy]-2-nitrobenzoic acid | CAS Registry Number: 50594-66-6
Synonyms: Acifluorfen, Acifluorfene, Tackle, Carbofluorfen, Scifluorfen, Blazer, Acifluorfen [BSI:ISO], Acifluorfene [ISO-French], PS1016_SUPELCO, C14H7ClF3NO5, CCRIS 3491, MLS001066351, 34311_RIEDEL, EINECS 256-634-5, PPG-847, CID44073, BRN 2953865, LS-7176, RH 6201, RH-6201

Molecular Formula: C14H7ClF3NO5Molecular Weight: 361.657290 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: NUFNQYOELLVIPL-UHFFFAOYSA-N

• 5-Chloro-8-Quinolinoloxine
IUPAC Name: 5-chloroquinolin-8-ol | CAS Registry Number: 130-16-5
Synonyms: cloxyquin, Cloxiquine, Dermofongin, Chlorisept, Chloroxychinolin, Dermofongin A, 5-Chlorooxine, 5-Chloro-8-quinolinol, Dermofungin, 8-Quinolinol, 5-chloro-, Cloxyquin [USAN], Monochlorohydroxyquinoline, Cloxiquine (INN), 5-Chloro-8-oxyquinoline, Cloxyquin (USAN), 5-Chlor-8-chinolinol, Cloxiquinum [INN-Latin], 8-Hydroxy-5-chloroquinoline, Spectrum_000820, 5-Chloroquinolin-8-ol

Molecular Formula: C9H6ClNOMolecular Weight: 179.603040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: CTQMJYWDVABFRZ-UHFFFAOYSA-N

• 5-Cyanophthalide
IUPAC Name: 1-oxo-3H-2-benzofuran-5-carbonitrile | CAS Registry Number: 82104-74-3
Synonyms: 5-Cyano-3H-isobenzofuranone, 647195_ALDRICH, ZINC00337934, EINECS 279-900-2, CID821218, TL8005440, 1,3-Dihydro-1-oxo-5-isobenzofurancarbonitrile, 1,3-Dihydro-1-oxoisobenzofuran-5-carbonitrile, 1-oxo-1,3-dihydro-2-benzofuran-5-carbonitrile, AR-011/40257489

Molecular Formula: C9H5NO2Molecular Weight: 159.141500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XEEGWTLAFIZLSF-UHFFFAOYSA-N

• 5-Difluoro Methoxy-2[[(3,4-Dimethoxy-2 -Pyridinyl) Methyl]Thio]-1 -H- Benzimidazole (Sulphide)
IUPAC Name: 6-(difluoromethoxy)-2-[(3,4-dimethoxypyridin-2-yl)methylsulfanyl]-1H-benzimidazole | CAS Registry Number: 102625-64-9
Synonyms: 5-Difluoromethoxy-2-[(3,4-dimethoxy-2-pyridinyl)methyl]thio-1H-benzimidazole, 5-DIFLUOROMETHOXY-2-, SBB070987, 5-Difluoromethoxy-2-{[(3,4-dimethoxy-2-pyridinyl)methyl]thio}-1H-benzimidazole, 5-difluoromethoxy-2-{((3,4-dimethoxy-2-pyridinyl)methyl)thio}-1h-benzimidazole, Pantoprazole sulfide, Pantoprazole thioether, PubChem20403, ACMC-1BOUK, UNII-BWZ6X03HIB, SureCN537800, KSC498E9N, Pantoprazole related compound B, Jsp000294, CTK3J8296, MolPort-003-849-784, ANW-14723, ZINC16158998, )METHYLTHIO]-1H-BENZIMIDAZOLE, AKOS015895368

Molecular Formula: C16H15F2N3O3SMolecular Weight: 367.370406 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 8

InChIKey: UKILEIRWOYBGEJ-UHFFFAOYSA-N

• 5-Difluoromethoxy 2 Mercaptobenzimidazole
IUPAC Name: 5-(difluoromethoxy)-1,3-dihydrobenzimidazole-2-thione | CAS Registry Number: 97963-62-7
Synonyms: 5-(Difluoromethoxy)-2-mercapto-1H-benzimidazole, 5-DIFLUOROMETHOXY-2-MERCAPTO-1H-BENZIMIDAZOLE, 5-Difluoromethoxy-2-thio-benzimidazole, AG-H-98497, 5-(Difluoromethoxy)-2-benzimidazolethiol, 2-Mercapto-5-difluoromethoxy benzimidazole, 5-(Difluoromethoxy)-2-mercaptobenzimidazole, 5-(difluoromethoxy)-1H-benzimidazole-2-thiol, 5-(Difluoromethoxy)-1H-benzo[d]imidazole-2-thiol, AN-829/25059002, 5-(difluoromethoxy)-1,3-dihydrobenzimidazole-2-thione, 5-(difluoromethoxy)-1,3-dihydro-2H-benzimidazole-2-thione, ZINC03882895, PubChem7125, AC1NN9SR, ACMC-209s9c, SureCN482378, SureCN2108226, KSC486M2B, UNII-39P59C89NV

Molecular Formula: C8H6F2N2OSMolecular Weight: 216.207846 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: HJMVPNAZPFZXCP-UHFFFAOYSA-N

• 5-Methyl-1,2,4-Triazole [3,4-B]Benzothiazole
IUPAC Name: 8-methyl-[1,2,4]triazolo[3,4-b][1,3]benzothiazole | CAS Registry Number: 41814-78-2
Synonyms: Tricyclazone, Blascide, Pilarblas, Trizole, Tizole, Sivic, Beam, Tricyclazol, TRICYCLAZOLE, Blas-T, Elanco 291, Caswell No. 884C, Tricyclazole [ANSI:BSI:ISO], C9H7N3S, 45808_RIEDEL, EINECS 255-559-5, EL-291, EPA Pesticide Chemical Code 120201, BRN 0980261, s-Triazolo(3,4-b)benzothiazole, 5-methyl-

Molecular Formula: C9H7N3SMolecular Weight: 189.236980 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DQJCHOQLCLEDLL-UHFFFAOYSA-N

• 6-Mercaptopurine
IUPAC Name: 3,7-dihydropurine-6-thione | CAS Registry Number: 50-44-2
Synonyms: mercaptopurine, Mercapurin, Leupurin, Mercaleukin, Purinethiol, Purinethol, Leukerin, 6-Mercaptopurin, Ismipur, 6-Thioxopurine, 6-Purinethiol, 6-Thiopurine, Mern, Mercaleukim, Purimethol, Leukeran, Puri-Nethol, 6-Thiohypoxanthine, Purine-6-thiol, 3H-Purine-6-thiol

Molecular Formula: C5H4N4SMolecular Weight: 152.177060 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: GLVAUDGFNGKCSF-UHFFFAOYSA-N

• 2-(Benzylthio)nicotinic acid
IUPAC Name: 2-benzylsulfanylpyridine-3-carboxylic acid | CAS Registry Number: 112811-90-2
Synonyms: 2-(benzylthio)nicotinic acid, 2-Benzylsulfanyl-nicotinic acid, 2-(benzylsulfanyl)nicotinic acid, SBB053014, 2-[benzylthio]nicotinic acid, 3-Pyridinecarboxylicacid, 2-[(phenylmethyl)thio]-, PubChem10737, ACMC-20cuk0, AC1Q5UUI, ChemDiv3_013058, 2-Thiobenzylnicotinic Acid, AC1LFQ53, SureCN3594763, MLS000046237, 2-Benzylsulfanylnicotinic acid, CTK0H4672, MolPort-001-769-484, HMS1510B12, HMS2446N24, AR-1C8579

Molecular Formula: C13H11NO2SMolecular Weight: 245.296940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: OJNZDGDYAXCHPB-UHFFFAOYSA-N

• 2,4-Dibromo thiophene
IUPAC Name: 2,4-dibromothiophene | CAS Registry Number: 3140-92-9
Synonyms: 2,4-Dibromothiophene, Thiophene, 2,4-dibromo-, ZINC02168779, CID2724560, ST5405449, TL8002398, InChI=1/C4H2Br2S/c5-3-1-4(6)7-2-3/h1-2

Molecular Formula: C4H2Br2SMolecular Weight: 241.931680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: WAQFYSJKIRRXLP-UHFFFAOYSA-N

• 2-Methyl-4'-(methylthio)-2-Morpholinopropiophenone
IUPAC Name: 2-methyl-1-(4-methylsulfanylphenyl)-2-morpholin-4-ylpropan-1-one | CAS Registry Number: 71868-10-5
Synonyms: MLS000084908, 405639_ALDRICH, CID92387, SMR000019254, ST5319490, EU-0035716, 2-Methyl-4'-(methylthio)-2-morpholinopropiophenone, 2-Methyl-1-[4-(methylsulfanyl)phenyl]-2-(4-morpholinyl)-1-propanone, 2-methyl-1-[4-(methylsulfanyl)phenyl]-2-morpholin-4-ylpropan-1-one, 2-methyl-1-[4-(methylthio)phenyl]-2-morpholin-4-ylpropan-1-one, 1-Propanone, 2-methyl-1-(4-(methylthio)phenyl)-2-(4-morpholinyl)-, 1-Propanone, 2-methyl-1-[4-(methylthio)phenyl]-2-(4-4-morpholinyl)-, 1-Propanone, 2-methyl-1-[4-(methylthio)phenyl]-2-(4-morpholinyl)-, 123584-61-2, 125732-34-5

Molecular Formula: C15H21NO2SMolecular Weight: 279.397740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LWRBVKNFOYUCNP-UHFFFAOYSA-N

• 4-Nitrobenzyl Chloroformate
IUPAC Name: (4-nitrophenyl)methyl carbonochloridate | CAS Registry Number: 4457-32-3
Synonyms: 4-Nitrobenzyl chloroformate, 4-Nitrocarbobenzoxychloride, 222801_ALDRICH, EINECS 224-708-6, ZINC02567962, Formic acid, chloro-, p-nitrobenzyl ester, Carbonochloridic acid, (4-nitrophenyl)methyl ester, TL8003108

Molecular Formula: C8H6ClNO4Molecular Weight: 215.590540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: MHSGOABISYIYKP-UHFFFAOYSA-N

• 4-Bromomethyl-Biphenyl-2-Carboxylic Aciid Methyl Ester
IUPAC Name: methyl 2-[4-(bromomethyl)phenyl]benzoate | CAS Registry Number: 114772-38-2
Synonyms: Methyl 2-[4-(bromomethyl)phenyl]benzoate, Methyl 4'-bromomethylbiphenyl-2-carboxylate, Methyl 4'-bromomethyl biphenyl-2-carboxylate, Methyl 4'-bromomethyl-2-biphenylcarboxylate, Methyl 4'-bromomethyl-biphenyl-2-carboxylate, Methyl 4'-(Bromomethyl)biphenyl-2-carboxylate, 2-[4-(Bromomethyl)phenyl]benzoic Acid Methyl Ester, Methyl 2-(4'-Bromomethylphenyl)benzoate, 2'-(Methoxycarbonyl)biphenyl-4-ylmethyl Bromide, Methyl 4'-(Bromomethyl)-1,1'-biphenyl-2-carboxylate, 4'-Bromomethylbiphenyl-2-carboxylic Acid, Methyl Ester, 4'-Bromomethyl-(1,1'-biphenyl)-2-carboxylic acid methyl ester, [1,1'-BIPHENYL]-2-CARBOXYLIC ACID, 4'-(BROMOMETHYL)-, METHYL ESTER, 133240-26-3, PubChem8968, SureCN562, ACMC-2099lk, Jsp001090, CTK4B8432, RMXGTMRDXKUUDJ-UHFFFAOYSA-

Molecular Formula: C15H13BrO2Molecular Weight: 305.166520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RMXGTMRDXKUUDJ-UHFFFAOYSA-N

• 4-Fluoro-alpha-(2-methyl-1-oxopropyl)-gamma-oxo-N,beta-diphenylbenzenebutaneamide
IUPAC Name: 2-[2-(4-fluorophenyl)-2-oxo-1-phenylethyl]-4-methyl-3-oxo-N-phenylpentanamide | CAS Registry Number: 125971-96-2
Synonyms: 2[2-(4-Fluorophenyl)-2-oxo-1-phenylethyl]-4-methyl-3-oxo-pentanoic acid phenylamide, 2-(2-(4-fluorophenyl)-2-oxo-1-phenylethyl)-4-methyl-3-oxo-N-phenylpentanamide, 4-Fluoro-Alpha-(2-Methyl-1-Oxopropyl)-Gamma-Oxo-N,Beta-Diphenylbenzene Butaneamide, 2-[2-(4-fluorophenyl)-2-oxo-1-phenylethyl]-4-methyl-3-oxo-N-phenylpentanamide, 4-Fluoro-alpha-(2-methyl-1-oxopropyl)-gamma-oxo-N,bata-diphenylbenzene butaneamide, ATORVASTATIN M4, PubChem19818, ACMC-1C6GE, AGN-PC-00GCEO, CTK8B6008, MolPort-019-918-530, ANW-51931, ATORVASTATIN INTERMEDIATE (II), AKOS015840719, AM90284, CL23799, MCULE-1452311956, YF10013, AK-25339, BR-25339

Molecular Formula: C26H24FNO3Molecular Weight: 417.472063 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: SNPBHOICIJUUFB-UHFFFAOYSA-N

• 1-(2,3-Dichlorophenyl) Piperazine
IUPAC Name: 1-(2,3-dichlorophenyl)piperazin-4-ium | CAS Registry Number: 41202-77-1
Synonyms: ZINC00386729, CID6950013

Molecular Formula: C10H13Cl2N2+Molecular Weight: 232.129620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: UDQMXYJSNNCRAS-UHFFFAOYSA-O

• 7-Hydroxy-3,4-Dihydrocarbostyril
IUPAC Name: 7-hydroxy-3,4-dihydro-1H-quinolin-2-one | CAS Registry Number: 22246-18-0
Synonyms: 3,4-Dihydro-7-hydroxy-2(1H)-quinolinone, 7-hydroxy-3,4-dihydro-1H-quinolin-2-one, 7-Hydroxy-3,4-dihydrocarbostyril, 7-Hydroxy-3,4-dihydro-2(1H)-quinolinone, 7-Hydroxy-3,4-dihydro carbostyril, 7-Hydroxy-3,4-dihydro-quinolin-2-one, 7-hydroxy-3,4-dihydroquinolin-2(1H)-one, 3,4-Dihydro-7-hydroxycarbostyril, STK617335, AG-E-62602, 7-Hydroxy-1,2,3,4-tetrahydro-2-quinolinone, 7-hydroxy-1,2,3,4-tetrahydroquinolin-2-one, 7-Hydroxy-2-oxo-1,2,3,4-tetrahydroquinoline, 2(1H)-QUINOLINONE, 3,4-DIHYDRO-7-HYDROXY-, 7-Hydroxy-3,4-dihydroquinolin-2[1H]-one, zlchem 327, PubChem14908, SureCN8751, AGN-PC-00AXYB, AC1MD98D

Molecular Formula: C9H9NO2Molecular Weight: 163.173260 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LKLSFDWYIBUGNT-UHFFFAOYSA-N

• 6,8-Dichloroethylcaprylate
IUPAC Name: ethyl 6,8-dichlorooctanoate | CAS Registry Number: 1070-64-0
Synonyms: 6,8-Dichlorooctanoic acid ethyl ester, BRN 1771820, LS-97965, OCTANOIC ACID, 6,8-DICHLORO-, ETHYL ESTER, 4-02-00-00998 (Beilstein Handbook Reference)

Molecular Formula: C10H18Cl2O2Molecular Weight: 241.154720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RFYDWSNYTVVKBR-UHFFFAOYSA-N

• 5-Ethylpyridine-2,3-dicarboxylic acid diethyl ester
IUPAC Name: diethyl 5-ethylpyridine-2,3-dicarboxylate | CAS Registry Number: 105151-39-1
Synonyms: TPC-PY075, 5-Ethyl-Pyridine-2,3-Dicarboxylic Acid Diethyl Ester

Molecular Formula: C13H17NO4Molecular Weight: 251.278380 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: VSPXTWXXNZJEHM-UHFFFAOYSA-N

• (3S,4R)-4-(4-Fluorophenyl)-3-hydroxymethyl-1-methylpiperidine
IUPAC Name: [(3S,4R)-4-(4-fluorophenyl)-1-methylpiperidin-1-ium-3-yl]methanol | CAS Registry Number: 105812-81-5
Synonyms: ZINC02529787, CID7016838, TL8000217, (3S,4R)-4-(4'-Fluorophenyl)-3-hydroxymethyl-1-methylpiperidine

Molecular Formula: C13H19FNO+Molecular Weight: 224.294463 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: CXRHUYYZISIIMT-AAEUAGOBSA-O

• [3-Methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methonol
IUPAC Name: [3-methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl]methanol | CAS Registry Number: 103577-66-8
Synonyms: (3-Methyl-4-(2,2,2-trifluoroethoxy)pyridin-2-yl)methanol, 2-Pyridinemethanol, 3-methyl-4-(2,2,2-trifluoroethoxy)-, 2-Pyridinemethanol,3-methyl-4-(2,2,2-trifluoroethoxy)-, 2-Hydroxymethyl-3-methyl-4-(2,2,2-thifluoroethoxy)pyridine, [3-Methyl-4-(2,2,2-trifluoro-ethoxy)-pyridin-2-yl]-methanol, ACMC-20a2tv, AGN-PC-004UDG, SureCN1681095, PYR399, CTK4A2201, MolPort-002-461-986, ANW-54593, ZINC12958690, AKOS015962961, AC-6873, AG-D-14588, CCG-211276, AK-55955, KB-207431, M-1949

Molecular Formula: C9H10F3NO2Molecular Weight: 221.176410 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: GNILTGRCVCMPFJ-UHFFFAOYSA-N


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