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Ningbo Pangs Chem Int'l Co., Ltd.

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Profile: Ningbo Pangs Chem Int'l Co., Ltd. is a supplier of natural plant extracts, nutritional supplements and chemical materials. Our product line includes pharmaceutical chemicals such as 4-hydroxycoumarin, 5-fluorouracil, adenine, baclofen, biapenem, captopril, dimetridazole, glimepiride, nateglinide, niflumic acid, morniflumate, chitosan and metoprolol. We offer nutritional additives such as fructose, chondroitin sulfate, melatonin, calcium caseinate, calcium citrate, calcium gluconate, ferrous lactate and potassium sorbate.

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• 1-(2-Pyrimidyl) Piperazine
IUPAC Name: 2-piperazin-1-ylpyrimidine | CAS Registry Number: 20980-22-7
Synonyms: Campiron, Campirone, Kampirone, 1-(2-Pyrimidyl)piperazine, 2-(1-Piperazinyl)pyrimidine, 2-Piperazino-pyrimidine, Maybridge1_004282, N-(2-Pyrimidinyl)piperazine, 1-(2-Pyrimidinyl)piperazine, 4-(2-Pyrimidinyl)piperazine, 2-(Piperazin-1-yl)pyrimidine, 1-PP, 2-piperazin-1-yl-pyrimidine, 1-Pyrimidin-2-yl-piperazine, Pyrimidine, 2-(1-piperazinyl)-, 421235_ALDRICH, EINECS 244-135-5, C8H12N4, CID88747, BRN 0151178

Molecular Formula: C8H12N4Molecular Weight: 164.207680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: MRBFGEHILMYPTF-UHFFFAOYSA-N

• 2-Amino Pyrimidine
IUPAC Name: pyrimidin-2-amine | CAS Registry Number: 109-12-6
Synonyms: 2-Pyrimidinamine, Aminopyrimidine, Pyrimidinamine, 2-AMINOPYRIMIDINE, 2-Pyrimidiylamine, 2-Pyridiylamine, Pyrimidin-2-ylamine, Pyrimidine, 2-amino-, Pyrimidine, amino-, pyrimidin-2-amine, 1,2-Dihydro-2-iminopyrimidine, A78608_ALDRICH, NSC 1912, 09380_FLUKA, CHEBI:38618, EINECS 203-648-4, NSC1912, AIDS020786, AIDS-020786, Pyrimidine, 1,2-dihydro-2-imine-

Molecular Formula: C4H5N3Molecular Weight: 95.102600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: LJXQPZWIHJMPQQ-UHFFFAOYSA-N

• 2-Amino-3-Methyl Benzoic Acid
IUPAC Name: 2-amino-3-methylbenzoic acid | CAS Registry Number: 4389-45-1
Synonyms: 2-Amino-3-methylbenzoic acid, 3-Methylanthranilic acid, 3-methylanthranilate, 3-Methylanthranil acid, 2-Amino-3-methylbenzate, 3 -methylanthranilic acid, 3-Methyl-2-aminobenzoic acid, m-Toluic acid, 2-amino-, Benzoic acid, 2-amino-3-methyl-, A62205_ALDRICH, 2-AMINO-M-TOLUIC ACID, 08401_FLUKA, m-Toluic acid, 2-amino- (8CI), NSC16049, EINECS 224-505-2, CPD0-1490, NSC 16049, Benzoic acid, 2-amino-3-methyl- (9CI), ST5437295, TL8003074

Molecular Formula: C8H9NO2Molecular Weight: 151.162560 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WNAJXPYVTFYEST-UHFFFAOYSA-N

• 2-Isopropyl-4-Methyl-6-Hydroxy Pyrimidine
IUPAC Name: 6-methyl-2-propan-2-yl-1H-pyrimidin-4-one | CAS Registry Number: 2814-20-2
Synonyms: IMHP, Enamine_000328, MET90B_SUPELCO, HSDB 5899, 375144_ALDRICH, CHEBI:38629, EINECS 220-561-7, 6-Pyrimidinol, 2-isopropyl-4-methyl, CID17777, 2-Isopropyl-6-methyl-4-pyrimidinol, 2-isopropyl-6-methylpyrimidin-4-ol, SBB009916, ZINC00136241, 2-Isopropyl-4-methyl-6-hydroxypyrimidine, 2-Isopropyl-6-methyl-1H-pyrimidin-4-one, 2-ISOPROPYL-6-METHYL-4-PYRIMIDONE, 4(1H)-Pyrimidinone, 6-methyl-2-(1-methylethyl)-, 4(3H)-Pyrimidinone, 2-isopropyl-6-methyl-, 2-isopropyl-6-methylpyrimidin-4(1H)-one, 6-methyl-2-(propan-2-yl)pyrimidin-4-ol

Molecular Formula: C8H12N2OMolecular Weight: 152.193680 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: AJPIUNPJBFBUKK-UHFFFAOYSA-N

• 2,4-Dimethyl Acetophenone
IUPAC Name: 1-(2,4-dimethylphenyl)ethanone | CAS Registry Number: 89-74-7
Synonyms: Acetyl-m-xylene, 2,4-Dimethylacetophenone, 2',4'-Dimethylacetophenone, Acetophenone, 2',4'-dimethyl-, Ethanone, 1-(2,4-dimethylphenyl)-, D138207_ALDRICH, W238708_ALDRICH, FEMA No. 2387, 38871_FLUKA, Methyl 2,4-dimethylphenyl ketone, NSC15333, EINECS 201-935-9, 1-(2,4-DIMETHYLPHENYL)ETHANONE, NSC 15333, ZINC01706892, Acetophenone, 2',4'-dimethyl- (8CI), AI3-20801, ST5331351

Molecular Formula: C10H12OMolecular Weight: 148.201680 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HSDSKVWQTONQBJ-UHFFFAOYSA-N

• 3,5-Dinitro-2-Toluic Acid
IUPAC Name: 2-methyl-3,5-dinitrobenzoic acid | CAS Registry Number: 28169-46-2
Synonyms: 3,5-Dinitro-o-toluic acid, 3,5-Dinitrotoluic acid, o-Toluic acid, 3,5-dinitro-, 2-Methyl-3,5-dinitrobenzoic acid, CBDivE_000040, 211427_ALDRICH, Benzoic acid, 2-methyl-3,5-dinitro-, EINECS 248-880-7, NSC168527, NSC 168527, ST5308303, PB256785286

Molecular Formula: C8H6N2O6Molecular Weight: 226.143040 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: CDVNZMKTJIBBBV-UHFFFAOYSA-N

• 3-(4-Fluoro Benzoyl) Propionic Acid
IUPAC Name: 4-(4-fluorophenyl)-4-oxobutanoic acid | CAS Registry Number: 366-77-8
Synonyms: Maybridge1_000099, Haloperidol metabolite III, MixCom1_000187, 176478_ALDRICH, 3-(4-Fluorobenzoyl)propionic acid, 3-(4-Fluorobenzoyl)propanoic acid, 3-(4-Fluorobenzoyl]propionic acid, 3-(p-Fluorobenzoyl)-propionic acid, ALBB-005979, EINECS 206-679-1, beta-(4-Fluorobenzoyl)propionic acid, NSC408180, NSC 408180, 4-(4-Fluorophenyl)-4-oxobutanoic acid, Benzenebutanoic acid, 4-fluoro-gamma-oxo-, ST5114953, TL8002700, EU-0099945, R 11302, SR-01000597214-2

Molecular Formula: C10H9FO3Molecular Weight: 196.175063 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: WUYWHIAAQYQKPP-UHFFFAOYSA-N

• 4,4'-Dibromo Biphenyl
IUPAC Name: 1-bromo-4-(4-bromophenyl)benzene | CAS Registry Number: 92-86-4
Synonyms: p,p'-Dibromobiphenyl, 4,4'-DIBROMOBIPHENYL, Biphenyl, 4,4'-dibromo-, 4,4'-Dibromodiphenyl, 1,1'-Biphenyl, 4,4'-dibromo-, 229237_ALDRICH, 442398_SUPELCO, 34030_FLUKA, 4,4'-Dibromo-1,1'-biphenyl, NSC2098, NSC 2098, Biphenyl, 4,4'-dibromo- (8CI), EINECS 202-198-6, ZINC00388501, AI3-17378, TL8005902, A2375/0100447, InChI=1/C12H8Br2/c13-11-5-1-9(2-6-11)10-3-7-12(14)8-4-10/h1-8

Molecular Formula: C12H8Br2Molecular Weight: 311.999920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: HQJQYILBCQPYBI-UHFFFAOYSA-N

• 2,6-Dimethoxybenzoic Acid
IUPAC Name: 2,6-dimethoxybenzoic acid | CAS Registry Number: 1466-76-8
Synonyms: 2,6-DIMETHOXYBENZOIC ACID, Benzoic acid, 2,6-dimethoxy-, D131601_ALDRICH, EINECS 215-985-4, NSC 28591, AIDS018090, AIDS-018090, NSC28591, LS-37121, ST5213894, InChI=1/C9H10O4/c1-12-6-4-3-5-7(13-2)8(6)9(10)11/h3-5H,1-2H3,(H,10,11

Molecular Formula: C9H10O4Molecular Weight: 182.173300 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: MBIZFBDREVRUHY-UHFFFAOYSA-N

• 2-Mercapto Pyrimidine
IUPAC Name: 1H-pyrimidine-2-thione | CAS Registry Number: 1450-85-7
Synonyms: 2-Thiopyrimidine, 2-Mercaptopyrimidine, 2-Pyrimidinethiol, Pyrimidine-2-thiol, 2-Pyrimidinethione, Pyrimidine-1-thiol, 2(1H)-Pyrimidinethione, 129623_ALDRICH, AIDS023055, AIDS-023055, NSC48073, EINECS 215-917-3, EINECS 258-741-2, NSC193522, SBB007595, ZINC01649580, ZINC02008823, 19351-11-2 (DELETED), 107646-94-6 (DELETED), InChI=1/C4H4N2S/c7-4-5-2-1-3-6-4/h1-3H,(H,5,6,7

Molecular Formula: C4H4N2SMolecular Weight: 112.152960 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: HBCQSNAFLVXVAY-UHFFFAOYSA-N

• 2-Mercapto Thiazoline
IUPAC Name: 1,3-thiazolidine-2-thione | CAS Registry Number: 96-53-7
Synonyms: Mercaptothiazoline, Metabasal, Thyroidan, 2-Thiazolidinethione, 2-Thiothiazolidone, 2-Mercaptothiazoline, 2-Thiazolidenethione, 2-Thiozolidinethione, Sancelent 2MT, 2-Mercapto-2-thiazoline, Thiazoline-2-thiol, 2-Thiazoline-2-thiol, 1,3-Thiazolidine-2-thione, Thiazolidine-2-thione, Dihydro-2-thiazolethiol, Dihydrothiazole-2-thiol, 4,5-Dihydro-2-mercaptothiazole, Tetrahydrothiazole-2-thione, 2-Thiazolethiol, dihydro-, M6204_ALDRICH

Molecular Formula: C3H5NS2Molecular Weight: 119.208500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: WGJCBBASTRWVJL-UHFFFAOYSA-N

• 3,5-Difluoro Phenyl Acetic Acid
IUPAC Name: 2-(3,5-difluorophenyl)acetic acid | CAS Registry Number: 105184-38-1
Synonyms: 3,5-Difluorophenylacetic acid, 290440_ALDRICH, JRD-0005, SBB006660, TL8000200, InChI=1/C8H6F2O2/c9-6-1-5(3-8(11)12)2-7(10)4-6/h1-2,4H,3H2,(H,11,12

Molecular Formula: C8H6F2O2Molecular Weight: 172.128846 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: IGGNSAVLXJKCNH-UHFFFAOYSA-N

• 3,5-Dihydroxy Benzaldehyde
IUPAC Name: 3,5-dihydroxybenzaldehyde | CAS Registry Number: 26153-38-8
Synonyms: 3,5-Dihydroxybenzaldehyde, .alpha.-Resorcylic aldehyde, Benzaldehyde, 3,5-dihydroxy-, 368113_ALDRICH, 37523_FLUKA, CHEBI:50204, EINECS 247-479-4, ZINC02566024, FR-2389, InChI=1/C7H6O3/c8-4-5-1-6(9)3-7(10)2-5/h1-4,9-10

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

InChIKey: HAQLHRYUDBKTJG-UHFFFAOYSA-N

• 4,4'-Bipyridine
IUPAC Name: 4-pyridin-4-ylpyridine | CAS Registry Number: 553-26-4
Synonyms: 4,4'-Bipyridyl, 4,4'-Dipyridine, Bipyridine, 4,4-Bipyridyl, 4,4-Dipyridyl, 4-(4-Pyridyl)pyridine, gamma,gamma'-Bipyridyl, gamma,gamma'-Dipyridyl, 4,4'-DIPYRIDYL, 4,4-Bipyridin, 4,4'-Dipyridyl hydrate, nchem.100-comp11, .gamma.,.gamma.'-Bipyridyl, Maybridge3_006249, Dopamine Nmethyltransferase, 4,4'-bpy, CCRIS 2363, .gamma.,.gamma.'-Dipyridyl, CBDivE_014486, MLS000702205

Molecular Formula: C10H8N2Molecular Weight: 156.183920 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: MWVTWFVJZLCBMC-UHFFFAOYSA-N

• 1 Phenyl 3 Methyl 5 Pyrazolone
IUPAC Name: 5-methyl-2-phenyl-4H-pyrazol-3-one | CAS Registry Number: 89-25-8
Synonyms: edaravone, Norphenazone, Radicut, Norantipyrine, Developer Z, edarabone, Methylphenylpyrazolone, Phenylmethylpyrazolone, C.I. Developer 1, CI Developer 1, Phenyl methyl pyrazolone, Radicut (TN), 1-Phenyl-3-methyl-5-pyrazolone, 1-Phenyl-3-methylpyrazolone, Spectrum_000267, Tocris-0786, MCI-186, Edaravone (JAN/INN), 3-Methyl-1-phenyl-5-pyrazolone, Maybridge1_005738

Molecular Formula: C10H10N2OMolecular Weight: 174.199200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: QELUYTUMUWHWMC-UHFFFAOYSA-N

• 1,3,5-Tribromobenzene
IUPAC Name: 1,3,5-tribromobenzene | CAS Registry Number: 626-39-1
Synonyms: 1,3,5-TRIBROMOBENZENE, Benzene, 1,3,5-tribromo-, NCIOpen2_008123, 140066_ALDRICH, NSC62439, 90715_FLUKA, EINECS 210-947-3, NSC 62439, CID12279, AI3-15483, LS-32209, TL806114, ST5406609, InChI=1/C6H3Br3/c7-4-1-5(8)3-6(9)2-4/h1-3

Molecular Formula: C6H3Br3Molecular Weight: 314.800020 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: YWDUZLFWHVQCHY-UHFFFAOYSA-N

• 2,4,6-Tribromoaniline
IUPAC Name: 2,4,6-tribromoaniline | CAS Registry Number: 147-82-0
Synonyms: s-Tribromoaniline, Aniline tribromide, sym-Tribromoaniline, 2,4,6-TRIBROMOANILINE, Aniline, 2,4,6-tribromo-, Benzenamine, 2,4,6-tribromo-, TRIBROMOANILINE, 2,4,6-Tribromophenylamine, USAF DO-43, 2,4,6-Tribromobenzenamine, WLN: ZR BE DE FE, HSDB 2689, 163694_ALDRICH, NSC 2216, EINECS 205-700-1, NSC2216, AIDS019006, AIDS-019006, BRN 2209258, ZINC00262690

Molecular Formula: C6H4Br3NMolecular Weight: 329.814660 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: GVPODVKBTHCGFU-UHFFFAOYSA-N

• 2,2'-Dithiosalicylic Acid
IUPAC Name: 2-(2-carboxyphenyl)disulfanylbenzoic acid | CAS Registry Number: 119-80-2
Synonyms: Dithiosalicylic acid, 2,2'-Dithiodibenzoic acid, Bis(2-carboxyphenyl) disulfide, 2-Carboxyphenyl disulfide, Bis(o-carboxylphenyl) disulfide, Disulfide benzamide analog, Benzoic acid, 2,2'-dithiobis-, Bis(o-carboxyphenyl) disulfide, 2,2'-Dithiodi(benzoic acid), 2,2'-Dithiosalicylic acid, NSC213, 2,2'-Dithiobis(benzoic acid), MLS001216615, NSC 213, NSC5346, 2,2'-Dithiobis[benzoic acid], 389285_ALDRICH, NSC 5346, 43761_FLUKA, BENZOIC ACID, 2,2'-DITHIODI-

Molecular Formula: C14H10O4S2Molecular Weight: 306.356800 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: LBEMXJWGHIEXRA-UHFFFAOYSA-N

• 2,5-Dichloronitrobenzene
IUPAC Name: 1,4-dichloro-2-nitrobenzene | CAS Registry Number: 89-61-2
Synonyms: Nitro-p-dichlorobenzene, 2,5-DICHLORONITROBENZENE, 2,5-Dichloronitrobenzol, 1,4-Dichloro-2-nitrobenzene, 2,5-Dichlornitrobenzen, 1-Nitro-2,5-dichlorobenzene, Benzene, 1,4-dichloro-2-nitro-, Benzene, 2,5-dichloronitro-, WLN: WNR CG EG, CCRIS 3096, 2,5-Dichlornitrobenzen [Czech], 225371_ALDRICH, 36572_RIEDEL, 36040_FLUKA, EINECS 201-923-3, NSC6294, NSC 406125, BRN 0778109, NSC406125, ZINC01693389

Molecular Formula: C6H3Cl2NO2Molecular Weight: 191.999520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RZKKOBGFCAHLCZ-UHFFFAOYSA-N

• 2-Amino 6 Methoxy Benzothiazole
IUPAC Name: 6-methoxy-1,3-benzothiazol-2-amine | CAS Registry Number: 1747-60-0
Synonyms: 2-Amino-6-methoxybenzothiazole, 2-Benzothiazolamine, 6-methoxy-, 6-Methoxy-2-aminobenzothiazole, 2-Amino-6-methoxy benzothiazole, Benzothiazole, 2-amino-6-methoxy-, CCRIS 1393, 6-METHOXY-2-BENZOTHIAZOLAMINE, 6-Methoxybenzothiazol-2-ylamine, Oprea1_245185, A60806_ALDRICH, MLS000565568, 162590_ALDRICH, 2-Amino-6-methoxybenzothiophene, EINECS 217-130-0, 6-methoxy-1,3-benzothiazol-2-amine, NSC 27516, NSC27516, WLN: T56 BN DSJ CZ GO1, BRN 0131202, LS-939

Molecular Formula: C8H8N2OSMolecular Weight: 180.226920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: KZHGPDSVHSDCMX-UHFFFAOYSA-N

• 3,4,5-Trimethoxytoluene
IUPAC Name: 1,2,3-trimethoxy-5-methylbenzene | CAS Registry Number: 6443-69-2
Synonyms: Toluene, 3,4,5-trimethoxy-, 227714_ALDRICH, 1,2,3-Trimethoxy-5-methylbenzene, 92196_FLUKA, Benzene, 1,2,3-trimethoxy-5-methyl-, 5-Methylpyrogallol trimethyl ether, EINECS 229-239-0, ZINC00391984, ST5406464, TL8004566, InChI=1/C10H14O3/c1-7-5-8(11-2)10(13-4)9(6-7)12-3/h5-6H,1-4H

Molecular Formula: C10H14O3Molecular Weight: 182.216360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: KCIZTNZGSBSSRM-UHFFFAOYSA-N

• 3-Chloropropionyl Chloride
IUPAC Name: 3-chloropropanoyl chloride | CAS Registry Number: 625-36-5
Synonyms: 3-Chloropropionyl chloride, sGQDDHbqBS[MP@, 3-Chloropropanoyl chloride, Propanoyl chloride, 3-chloro-, Chloropropionyl chloride, Propionyl chloride, 3-chloro-, beta-Chloropropanoyl chloride, beta-Chloropropionyl chloride, beta-Chloropropionoyl chloride, C69128_ALDRICH, .beta.-Chloropropanoyl chloride, .beta.-Chloropropionyl chloride, 147443_ALDRICH, .beta.-Chloropropionoyl chloride, NSC84180, EINECS 210-890-4, NSC 84180, ZINC01736653, PROPANOIC ACID,3-CHLORO,CHLORIDE, LS-192508

Molecular Formula: C3H4Cl2OMolecular Weight: 126.969260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: INUNLMUAPJVRME-UHFFFAOYSA-N

• 3-Methyl-2-Thiophenecarboxylic Acid
IUPAC Name: 3-methylthiophene-2-carboxylic acid | CAS Registry Number: 23806-24-8
Synonyms: 3-Methyl-2-thiophenecarboxylic acid, 3-Methyl-2-thenoic acid, 248207_ALDRICH, 3-Methylthiophene-2-carboxylic acid, EINECS 245-894-5, ST5306827, TL8001966

Molecular Formula: C6H6O2SMolecular Weight: 142.175640 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: IFLKEBSJTZGCJG-UHFFFAOYSA-N

• 2,3-Dihydrobenzo[b]furan
IUPAC Name: 2,3-dihydro-1-benzofuran | CAS Registry Number: 496-16-2
Synonyms: Coumaran, 2,3-DIHYDROBENZOFURAN, Benzofuran, 2,3-dihydro-, 2,3-Dihydro-1-benzofuran, 183962_ALDRICH, EINECS 207-817-3, CID10329, SB 01482, LS-184879, C043168, InChI=1/C8H8O/c1-2-4-8-7(3-1)5-6-9-8/h1-4H,5-6H

Molecular Formula: C8H8OMolecular Weight: 120.148520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: HBEDSQVIWPRPAY-UHFFFAOYSA-N

• 5-Chloro-2-mercaptobenzothiazole
IUPAC Name: 5-chloro-3H-1,3-benzothiazole-2-thione | CAS Registry Number: 5331-91-9
Synonyms: SH-Benzothiazole, 5-Chloro-2-benzothiazolethiol, Maybridge1_006216, MLS000518963, Benzothiazole, 5-chloro-2-mercapto-, 125571_ALDRICH, NSC 3934, 2(3H)-Benzothiazolethione, 5-chloro-, EINECS 226-235-0, NSC3934, 2-BENZOTHIAZOLETHIOL, 5-CHLORO-, 5-chloro-1,3-benzothiazole-2-thiol, WLN: T56 BN DSJ CSH HG, SBB003526, SBB005398, ZINC00078878, ZINC00388162, LS-40832, SMR000129383, EU-0002999

Molecular Formula: C7H4ClNS2Molecular Weight: 201.696360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 0

InChIKey: NKYDKCVZNMNZCM-UHFFFAOYSA-N

• 2-(5-Mercaptotetrazole-1-yl)ethanol
IUPAC Name: 1-(2-hydroxyethyl)-2H-tetrazole-5-thione | CAS Registry Number: 56610-81-2
Synonyms: 2-(5-Mercaptotetrazole-1yl)ethanol, SBB066985, AG-F-98958, PubChem9174, SureCN1142098, CTK5A5418, CTK8A5114, MolPort-001-768-807, ACT07240, AKOS006306577, AKOS013465674, AG-C-19873, BCP9000079, KB-66898, FT-0080555, FT-0640399, 1-(2-Hydroxyethyl)-5-mercapto-1H-tetrazole, 2-(5-MERCAPTO-TETRAZOLE-1-YL)ETHANOL, |A-(5- Mercapto-1H- Tetrazole C1)-Ethanol, 2-(5-sulfanyl-1,2,3,4-tetrazol-1-yl)ethanol

Molecular Formula: C3H6N4OSMolecular Weight: 146.170940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: YKYUEQRWYGVUKB-UHFFFAOYSA-N

• (R,S)-Binol
IUPAC Name: 1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol | CAS Registry Number: 602-09-5
Synonyms: beta-Binaphthol, Chiral binaphthol, Bis-beta-naphthol, 1,1'-Bi-2-naphthol, 2,2'-Dinaphthol, .beta.-Binaphthol, 1,1'-Bis-2-naphthol, 2,2'-Dihydroxydinaphthyl, Bis-.beta.-naphthol, 2,2'-Dihydroxybinaphthalene, alpha-Binaphthyl-2,2'-diol, (R)-BINOL, (S)-BINOL, 2,2'-Dihydroxy-1,1'-binaphthyl, 2,2'-Dihydroxy-1,1'-dinaphthyl, 1,1'-Binaphthyl-2,2'-diol, [1,1'-Binaphthalene]-2,2'-diol, 104655_ALDRICH, 2,2'-Dihydroxy-1,1'-binaphthalene, 246948_ALDRICH

Molecular Formula: C20H14O2Molecular Weight: 286.323960 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: PPTXVXKCQZKFBN-UHFFFAOYSA-N

• 3-(2-Methylaminoethyl)indole
IUPAC Name: 2-(1H-indol-3-yl)-N-methylethanamine | CAS Registry Number: 61-49-4
Synonyms: N-Methyltryptamine, Dipterine, Methyltryptamine, N-Monomethyltryptamine, Indolalkylamine der., N.omega.-methyltryptamine, Maybridge3_003310, N(omega)-methyltryptamine, 1H-Indole-3-ethanamine, N-methyl-, N-OMEGA-METHYLTRYPTAMINE, Oprea1_433490, MLS000069493, 3-(2-(Methylamino)ethyl)indole, 115312_ALDRICH, (2-Indol-3-ylethyl)methylamine, 3-(2-[Methylamino]ethyl)indole, CHEBI:28136, EINECS 200-507-9, N-methyl-1H-indole-3-ethanamine, 2-(1H-Indol-3-yl)-N-methylethanamine

Molecular Formula: C11H14N2Molecular Weight: 174.242260 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: NCIKQJBVUNUXLW-UHFFFAOYSA-N

• 3-Methylether-estradiol
IUPAC Name: 3-methoxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-17-ol | CAS Registry Number: 94535-16-7
Synonyms: Maybridge3_004346, Oprea1_480901, 3-Methoxyestra-1,3,5(10)-trien-17-ol, IDI1_015733, LS-64800, ST5411319, ESTRA-1,3,5(10)-TRIEN-17-OL, 3-METHOXY-, Estra-1,3,5(10)-trien-17.beta.-ol, 3-methoxy-, 8.alpha.-Estra-1,3,5(10)-trien-17.beta.-ol, 3-methoxy-, Estra-1,3,5(10)-trien-17-ol, 3-methoxy-, (17.beta.)-, Estra-1,3,5(10)-trien-17-ol, 3-methoxy-, (8.alpha.,17.beta.)-, 17.beta.-Hydroxy-3-methoxy-estra-1,3,5(10)-triene (8.beta.,9.beta.,14.alpha.)

Molecular Formula: C19H26O2Molecular Weight: 286.408540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ULAADVBNYHGIBP-UHFFFAOYSA-N

• 3-Benzoylpyridine
IUPAC Name: phenyl(pyridin-3-yl)methanone | CAS Registry Number: 5424-19-1
Synonyms: Phenyl 3-pyridyl ketone, Pyridine, 3-benzoyl-, 3-Pyridyl phenyl ketone, Methanone, phenyl-3-pyridinyl-, Maybridge3_000706, WLN: T6NJ CVR, KETONE, PHENYL 3-PYRIDYL, phenyl-pyridin-3-ylmethanone, B14205_ALDRICH, phenyl(pyridin-3-yl)methanone, EINECS 226-561-3, NSC 13190, NSC13190, BRN 0120234, ZINC00136687, IDI1_012093, Methanone, phenyl-3-pyridinyl- (9CI), B253, LS-87348, ST5406332

Molecular Formula: C12H9NOMolecular Weight: 183.205960 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: RYMBAPVTUHZCNF-UHFFFAOYSA-N

• 1-Benzyl-3-piperidinone
IUPAC Name: 1-(phenylmethyl)piperidin-3-one | CAS Registry Number: 40114-49-6
Synonyms: 1-benzylpiperidin-3-one, NSC84168, ALBB-006393, CID96650, 3-Piperidinone, 1-(phenylmethyl)-, ST5406577

Molecular Formula: C12H15NOMolecular Weight: 189.253600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: BBQQULRBTOMLTC-UHFFFAOYSA-N

• 3-Methylpyrazole
IUPAC Name: 5-methyl-1H-pyrazole | CAS Registry Number: 1453-58-3
Synonyms: 5-Methylpyrazole, 3(5)-Methylpyrazole, Pyrazole, 5-methyl-, PYRAZOLE, 3-METHYL-, 5-methyl-1H-pyrazole, 1H-Pyrazole, 3-methyl-, M75802_ALDRICH, EINECS 215-925-7, BB_SC-3908, ALBB-006081, BRN 0001454, SBB004404, ZINC04701702, LS-128523, TL8001003, 5-23-05-00004 (Beilstein Handbook Reference), InChI=1/C4H6N2/c1-4-2-3-5-6-4/h2-3H,1H3,(H,5,6, 88054-14-2

Molecular Formula: C4H6N2Molecular Weight: 82.103840 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: XKVUYEYANWFIJX-UHFFFAOYSA-N

• 2-Methoxy-5-Methyl-N,N-Bis(1-Methylethyl)-Gamma-Phenylbenzene Propenamine Fumarate (CAS: 124935-89-3)
• 2,3-Dimethyl-1h-Benz[e]indole
IUPAC Name: 2,3-dimethyl-1,2-dihydrobenzo[e]indole | CAS Registry Number: 40174-39-8
Synonyms: 2,3-Dimethyl-1H-benzo[e]indole, 55970-05-3, 2,3-dimethyl-1,2-dihydrobenzo[e]indole, 2,3-Dimethyl-2,3-dihydro-1H-benzo[e]indole, 2,3-dimethyl-1h-benzo(e)indole, AGN-PC-01MK93, 2,3-dimethyl-1h-benz[e]indole, ANW-60369, AKOS006327121, AK101239, KB-164133, KB-164134, FT-0651698, ST51054054, A830871, I14-1297

Molecular Formula: C14H15NMolecular Weight: 197.275600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: UAMHYXAJSDOMEY-UHFFFAOYSA-N

• 1-N-Propylpiperazine Dihydrobromide
IUPAC Name: 1-propylpiperazine dihydrobromide | CAS Registry Number: 64262-23-3
Synonyms: N-Propylpiperazinium dibromide, 141674_ALDRICH, EINECS 264-759-1, CID3085288, LT03378926

Molecular Formula: C7H18Br2N2Molecular Weight: 290.039220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YTPQLWVHCBATKO-UHFFFAOYSA-N

• 1-[(4-Nitrophenyl)methyl]pyrazole
IUPAC Name: 1-[(4-nitrophenyl)methyl]pyrazole | CAS Registry Number: 110525-57-0
Synonyms: 1-(4-Nitrobenzyl)-1H-pyrazole, 1-[(4-nitrophenyl)methyl]pyrazole, 1H-Pyrazole,1-[(4-nitrophenyl)methyl]-, ZINC00614333, AC1LJG1C, ACMC-1BR6P, Ambcb7903531, SureCN7094207, [(4-nitrophenyl)methyl]pyrazole, CTK4A6926, MolPort-002-276-964, ANW-52310, RW2360, SBB093113, AKOS013124898, AG-D-28048, MCULE-6493732823, AK-21730, BR-21730, KB-09212

Molecular Formula: C10H9N3O2Molecular Weight: 203.197360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ZFWQFBNNHCBSFT-UHFFFAOYSA-N

• 1-Bromobutane
IUPAC Name: 1-bromobutane | CAS Registry Number: 109-65-9
Synonyms: Butyl bromide, Butane, 1-bromo-, n-Butylbromide, Bromobutane, N-BUTYL BROMIDE, 1-Butyl bromide, Butane, bromo-, sJPHAbIJuP@, 1-BROMO-BUTANE, CCRIS 831, HSDB 2195, 08953_FLUKA, 19681_FLUKA, B59497_SIAL, EINECS 203-691-9, UN1126, AI3-15308, LS-45622, TL8000306, 1-Bromobutane [UN1126] [Flammable liquid]

Molecular Formula: C4H9BrMolecular Weight: 137.018260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: MPPPKRYCTPRNTB-UHFFFAOYSA-N

• 2,4-Dichlorobenzotrifluoride
IUPAC Name: 1,4-dichloro-2-(trifluoromethyl)benzene | CAS Registry Number: 320-60-5
Synonyms: 2,5-Dichlorobenzotrifluoride, 246069_ALDRICH, NSC60712, EINECS 206-276-0, Benzene, 1,4-dichloro-2-(trifluoromethyl)-, CID35360, 1,4-Dichloro-2-(trifluoromethyl)benzene, LS-29823, ST5405472, 2,5-Dichloro-alpha,alpha,alpha-trifluorotoluene, Toluene, 2,5-dichloro-alpha,alpha,alpha-trifluoro- (6CI,7CI,8CI), 320-50-3

Molecular Formula: C7H3Cl2F3Molecular Weight: 214.999930 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: DYBYUWVMLBBEMA-UHFFFAOYSA-N

• 2,6-Dichlorobenzonitrile
IUPAC Name: 2,6-dichlorobenzonitrile | CAS Registry Number: 1194-65-6
Synonyms: dichlobenil, Dichlobanil, Casoron, Cyclomec, Decabane, Dyclomec, Surfassol, Norosac, Casoron gsr, DU-Sprex, Carsoron, Casaron, Prefix D, DBN (pesticide), Casoron 133, Casoron G-4, DBN (the herbicide), Casoron G-10, Casoron G20 SR, Casoron W-50

Molecular Formula: C7H3Cl2NMolecular Weight: 172.011420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: YOYAIZYFCNQIRF-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-Amino-4,5-Dimethoxy-Benzoic Acid
IUPAC Name: 2-amino-4,5-dimethoxybenzoic acid | CAS Registry Number: 5653-40-7
Synonyms: 6-Aminoveratric acid, 2-Amino-4,5-dimethoxybenzoic acid, 4,5-Dimethoxyanthranilic acid, 252042_ALDRICH, EINECS 227-095-3, SBB007800, FR-0358, Benzoic acid, 2-amino-4,5-dimethoxy-, TL8003658, InChI=1/C9H11NO4/c1-13-7-3-5(9(11)12)6(10)4-8(7)14-2/h3-4H,10H2,1-2H3,(H,11,12

Molecular Formula: C9H11NO4Molecular Weight: 197.187940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 5

InChIKey: HJVAVGOPTDJYOJ-UHFFFAOYSA-N

• 2-Amino-5-Nitrothiazole
IUPAC Name: 5-nitro-1,3-thiazol-2-amine | CAS Registry Number: 121-66-4
Synonyms: Entramin, Enheptin, Enheptin-T, Amnizol soluble, Nitramin IDO, Aminonitrothiazole, Aminzol soluble, Enheptin premix, Enheptin T, Enheptyne, Nitromin ido, Enheptin (VAN), 2-AMINO-5-NITROTHIAZOLE, Aminonitrothiazolum, 2-Thiazolamine, 5-nitro-, Thiazole, 2-amino-5-nitro-, 5-Nitro-2-thiazolylamine, 5-Nitro-2-thiazolamine, 5-Nitro-2-aminothiazole, NSC4

Molecular Formula: C3H3N3O2SMolecular Weight: 145.139820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: MIHADVKEHAFNPG-UHFFFAOYSA-N

• 2-Hydroxy-2-Mercaptopyrimidine
IUPAC Name: 2-sulfanylidene-1H-pyrimidin-4-one | CAS Registry Number: 141-90-2
Synonyms: 2-thiouracil, Antagothyroid, Thiouracil, Antagothyroil, Deracil, Nobilen, 6-Thiouracil, Uracil, 2-thio-, Tiouracyl [Polish], 2-Mercapto-4-pyrimidone, 2-Thiouracil (VAN), 2-Mercapto-4-pyrimidinol, 2-Thio-4-oxypyrimidine, 2-Thio-6-oxypyrimidine, 4-Hydroxy-2-pyrimidinethiol, 4-Hydroxy-2-mercaptopyrimidine, Ambap4491, Spectrum_001652, 4-Pyrimidinol, 2-mercapto-, SpecPlus_000746

Molecular Formula: C4H4N2OSMolecular Weight: 128.152360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 1

InChIKey: ZEMGGZBWXRYJHK-UHFFFAOYSA-N

• 2-Mercaptan Benzamidazole
IUPAC Name: 1,3-dihydrobenzimidazole-2-thione | CAS Registry Number: 583-39-1
Synonyms: Antiegene MB, 2-Mercaptobenzimidazole, 2-Benzimidazolethiol, Antioxidant MB, Antigene MB, Antigen MB, o-Phenylenethiourea, Benzimidazolethiol, Permanax 21, 2-Thiobenzimidazole, Mercaptobenzimidazole, Mercaptobenzoimidazole, Anitiegene MB, AOMB, 2-Thiol benzimidazole, 2-Benzimidazolinethione, ASM MB, Merkaptobenzimidazol, 1H-Benzimidazole-2-thiol, Benzimidazole-2-thiol

Molecular Formula: C7H6N2SMolecular Weight: 150.200940 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 0

InChIKey: YHMYGUUIMTVXNW-UHFFFAOYSA-N

• 2-Methylfuran
IUPAC Name: 2-methylfuran | CAS Registry Number: 534-22-5
Synonyms: Methylfuran, Sylvan, Furan, 2-methyl-, 2-METHYLFURAN, 5-Methylfuran, Silvan, 2-Methyl furan, alpha-Methylfuran, .alpha.-Methylfuran, Methyl furan, Silvan [Czech], Furan, methyl-, 2-METHYL-FURAN, CCRIS 2920, WLN: T5OJ B1, M46845_ALDRICH, W417901_ALDRICH, NSC 3707, EINECS 208-594-5, NSC3707

Molecular Formula: C5H6OMolecular Weight: 82.100540 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VQKFNUFAXTZWDK-UHFFFAOYSA-N

• 3,4,5-Trimethoxybenzaldehyde (TMBA)
IUPAC Name: 3,4,5-trimethoxybenzaldehyde | CAS Registry Number: 86-81-7
Synonyms: 3,4,5-TRIMETHOXYBENZALDEHYDE, Benzaldehyde, 3,4,5-trimethoxy-, T68403_ALDRICH, 92140_FLUKA, EINECS 201-701-6, BENZALDEHYDE,3,4,5-TRIMETHOXY-, NSC 16692, AIDS017928, AIDS-017928, NSC16692, BRN 0395163, SBB016338, ZINC02504375, AI3-36673, LS-25170, TL8005630, 4-08-00-02719 (Beilstein Handbook Reference), InChI=1/C10H12O4/c1-12-8-4-7(6-11)5-9(13-2)10(8)14-3/h4-6H,1-3H

Molecular Formula: C10H12O4Molecular Weight: 196.199880 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OPHQOIGEOHXOGX-UHFFFAOYSA-N

• 1,2:5,6-Di-O-isopropylidene-alpha-D-allofuranose
IUPAC Name: (3aR,5S,6R,6aR)-5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-6-ol | CAS Registry Number: 2595-05-3
Synonyms: Diacetoneglucose, ZINC04262105, CID7157054

Molecular Formula: C12H20O6Molecular Weight: 260.283600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: KEJGAYKWRDILTF-VVULQXIFSA-N

• 7-Azaindole
IUPAC Name: 1H-pyrrolo[2,3-b]pyridine | CAS Registry Number: 271-63-6
Synonyms: 1,7-Diazaindene, 7-Aza-1-pyrindine, 1,7-Dideazapurine, 1H-Pyrrolo[2,3-b]pyridine, 7H-Pyrrolo(2,3-b)pyridine, NCIOpen2_000707, WLN: T56 BM INJ, A95502_ALDRICH, 7H-Pyrrolo[2,3-b]pyridine, 1H-PYRROLO(2,3-b)PYRIDINE, EINECS 205-981-0, NSC 67063, ALBB-006259, NSC67063, NSC77951, SBB004295, ZINC00163728, LS-139467, TL8002195, A-9500

Molecular Formula: C7H6N2Molecular Weight: 118.135940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MVXVYAKCVDQRLW-UHFFFAOYSA-N

• 3-Hydroxy-1-methylpiperidine
IUPAC Name: 1-methylpiperidin-3-ol | CAS Registry Number: 3554-74-3
Synonyms: 1-Methyl-3-piperidinol, N-Methyl-3-piperidinol, 3-Piperidinol, 1-methyl-, N-Methyl-3-hydroxypiperidine, 1-Methylpiperidin-3-ol, 3-Hydroxy-N-methylpiperidine, 1-Methyl-3-hydroxypiperidine, H42001_ALDRICH, 55750_FLUKA, BB_SC-2158, NSC68348, EINECS 222-609-2, NSC 68348, TL8002638, 97275-25-7

Molecular Formula: C6H13NOMolecular Weight: 115.173520 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UKANCZCEGQDKGF-UHFFFAOYSA-N

• 1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazine
IUPAC Name: 1-(3-chlorophenyl)-4-(3-chloropropyl)piperazine | CAS Registry Number: 39577-43-0
Synonyms: NSC520934, EINECS 254-529-9, CID101444, ST5307311

Molecular Formula: C13H18Cl2N2Molecular Weight: 273.201420 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: NDQKGEFMUGSRNS-UHFFFAOYSA-N


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