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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-[(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

• 1,3,5-Trimethoxybenzene
IUPAC Name: 1,3,5-trimethoxybenzene | CAS Registry Number: 621-23-8
Synonyms: sym-Trimethoxybenzene, Phloroglucinol trimethyl ether, Benzene, 1,3,5-trimethoxy-, 1,3,5-Trimethyoxybenzene, Spectrum_001404, Spectrum2_000426, Spectrum3_001030, Spectrum4_001163, Spectrum5_001766, NCIOpen2_001419, BSPBio_002819, KBioGR_001765, KBioSS_001884, SPECTRUM231043, SPBio_000412, 138827_ALDRICH, O,O,O-1,3,5-Trimethylresorcinol, EINECS 210-673-4, KBio2_001884, KBio2_004452

Molecular Formula: C9H12O3Molecular Weight: 168.189780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: LKUDPHPHKOZXCD-UHFFFAOYSA-N

• 2,4-Dichlorobenzoic Acid
IUPAC Name: 2,4-dichlorobenzoic acid | CAS Registry Number: 50-84-0
Synonyms: 2,4-DICHLOROBENZOIC ACID, Benzoic acid, 2,4-dichloro-, 2,4-Dichlorobenzoate, WLN: QVR BG DG, NSC 578, 139572_ALDRICH, 36749_RIEDEL, NSC578, 35300_FLUKA, CHEBI:30748, EINECS 200-067-8, AIDS018019, AIDS-018019, BRN 1868192, LS-146, AI3-14873, NCGC00091214-01, TL806117, ST5213899, C06670

Molecular Formula: C7H4Cl2O2Molecular Weight: 191.011460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ATCRIUVQKHMXSH-UHFFFAOYSA-N

• 2,4-Diaminotoluene
IUPAC Name: 4-methylbenzene-1,3-diamine | CAS Registry Number: 95-80-7
Synonyms: Toluenediamine, Developer mtd, m-Toluenediamine, Fouramine, Fourrine M, m-Tolylenediamine, 2,4-Toluenediamine, Benzofur MT, Developer DBJ, Eucanine GB, Pelagol J, Tertral G, Pelagol Grey J, Developer MT-CF, Zogen developer H, Brown for Fur T, 2,4-Toluene diamine, Developer B, Developer T, Fouramine J

Molecular Formula: C7H10N2Molecular Weight: 122.167700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: VOZKAJLKRJDJLL-UHFFFAOYSA-N

• 2,6-Difluorobenzonitrile
IUPAC Name: 2,6-difluorobenzonitrile | CAS Registry Number: 1897-52-5
Synonyms: Benzonitrile, 2,6-difluoro-, 2,6-Difluoro-benzonitrile, 186783_ALDRICH, 2,6-DIFLUORO BENZONITRILE, ZINC00164372, BB_SC-4524, CID74695, JRD-0121, EINECS 217-589-7, TL8001545, InChI=1/C7H3F2N/c8-6-2-1-3-7(9)5(6)4-10/h1-3

Molecular Formula: C7H3F2NMolecular Weight: 139.102226 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: BNBRIFIJRKJGEI-UHFFFAOYSA-N

• 2-Amino-5,6-Dichloro Benzothiazole
IUPAC Name: 5,6-dichloro-1,3-benzothiazol-2-amine | CAS Registry Number: 24072-75-1
Synonyms: CCRIS 742, 2-Benzothiazolamine, 5,6-dichloro-, 5,6-Dichlorobenzothiazol-2-amine, EINECS 246-006-9, 5,6-DICHLORO-2-BENZOTHIAZOLAMINE, 2-Amino-5,6-dichloro-benzothiazole, LS-1037, 5,6-Dichloro-1,3-benzothiazol-2-amine, SL-02027

Molecular Formula: C7H4Cl2N2SMolecular Weight: 219.091060 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GHKHTBMTSUEBJD-UHFFFAOYSA-N

• 2-Chlorobenzothiazole
IUPAC Name: 2-chloro-1,3-benzothiazole | CAS Registry Number: 615-20-3
Synonyms: BENZOTHIAZOLE, 2-CHLORO-, USAF EK-2784, 2-Chloro-1,3-benzothiazole, 167576_ALDRICH, WLN: T56 BN DSJ CG, NSC 8442, EINECS 210-415-0, NSC8442, AIDS019691, AIDS-019691, BRN 0116316, ZINC00152274, AI3-63118, AC 17349, LS-40712, 4-27-00-01072 (Beilstein Handbook Reference), InChI=1/C7H4ClNS/c8-7-9-5-3-1-2-4-6(5)10-7/h1-4

Molecular Formula: C7H4ClNSMolecular Weight: 169.631360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BSQLQMLFTHJVKS-UHFFFAOYSA-N

• 3 Fluoroiodobenzene
IUPAC Name: 1-fluoro-3-iodobenzene | CAS Registry Number: 1121-86-4
Synonyms: m-Fluoroiodobenzene, m-Iodofluorobenzene, 3-Fluoroiodobenzene, 3-Iodofluorobenzene, 1-Fluoro-3-iodobenzene, Ambap32, Benzene, 1-fluoro-3-iodo-, nchembio.87-comp33, 1-Fluoro-3-iodo-benzene, 219398_ALDRICH, NSC10279, EINECS 214-339-9, NSC 10279, InChI=1/C6H4FI/c7-5-2-1-3-6(8)4-5/h1-4

Molecular Formula: C6H4FIMolecular Weight: 221.998833 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VSKSBSORLCDRHS-UHFFFAOYSA-N

• 3,5-Dihydroxybenzyl Alcohol
IUPAC Name: 5-(hydroxymethyl)benzene-1,3-diol | CAS Registry Number: 29654-55-5
Synonyms: 3,5-Dihydroxybenzyl alcohol, 5-(Hydroxymethyl)resorcinol, Ambap7677, 396206_ALDRICH, EINECS 249-751-8, BRN 2326351, BENZYL ALCOHOL, 3,5-DIHYDROXY-, ZINC00388547, LS-42852, TL8002310, 3-06-00-06326 (Beilstein Handbook Reference)

Molecular Formula: C7H8O3Molecular Weight: 140.136620 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 3

InChIKey: NGYYFWGABVVEPL-UHFFFAOYSA-N

• 3-Chloride-2-Methaniline
IUPAC Name: 3-chloro-2-methylaniline | CAS Registry Number: 87-60-5
Synonyms: 3-Chloro-o-toluidine, Scarlet TR Base, 3-Chloro-2-methylaniline, 2-Amino-6-chlorotoluene, o-Toluidine, 3-chloro-, Fast Scarlet TR Base, 3-Chloro-2-toluidine, o-Methyl-m-chloroaniline, 6-Chloro-2-aminotoluene, Azoic Diazo Component 46, 3-Chlor-2-toluidin, Benzenamine, 3-chloro-2-methyl-, 6-Chloro-ortho-toluidine, para-Chloro-ortho-toluidine, Toluene, 2-amino-6-chloro-, 3-Chlor-2-toluidin [Czech], 3-Chloro-2-toluidin [Czech], WLN: ZR CG B1, 1-Amino-3-chloro-2-methylbenzene, HSDB 5252

Molecular Formula: C7H8ClNMolecular Weight: 141.598120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: ZUVPLKVDZNDZCM-UHFFFAOYSA-N

• 3,4-Dihydroxy benzonitrile
IUPAC Name: 3,4-dihydroxybenzonitrile | CAS Registry Number: 17345-61-8
Synonyms: Protocatechuonitrile, 3,4-Dihydroxybenzonitrile, 538396_ALDRICH, EINECS 241-367-9, SBB008582, ZINC00157092, FR-2291, TL8001371

Molecular Formula: C7H5NO2Molecular Weight: 135.120100 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: NUWHYWYSMAPBHK-UHFFFAOYSA-N

• 2-Butyl-3-(3',5'-diiodo-4-hydroxybenzonyl)benzofuran
IUPAC Name: (2-butyl-1-benzofuran-3-yl)-(4-hydroxy-3,5-diiodophenyl)methanone | CAS Registry Number: 1951-26-4
Synonyms: CID74769, NSC85437, EINECS 217-773-7, SL-00818, C15143, L 3373, (2-Butylbenzofuran-3-yl) (4-hydroxy-3,5-diiodophenyl) ketone, (2-Butylbenzofuran-3-yl)(4-hydroxy-3,5-diiodophenyl)ketone

Molecular Formula: C19H16I2O3Molecular Weight: 546.137480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PNFMEGSMKIHDFZ-UHFFFAOYSA-N

• 3-(2,6-Dichlorophenyl)-5-methylisoxazole-4-carbonyl chloride
IUPAC Name: 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carbonyl chloride | CAS Registry Number: 4462-55-9
Synonyms: ZINC02510210, CID78212, EINECS 224-723-8, ST5411830, 3-(2,6-Dichlorophenyl)-5-methylisoxazole-4-carboxylic acid chloride, 4-Isoxazolecarbonyl chloride, 3-(2,6-dichlorophenyl)-5-methyl-

Molecular Formula: C11H6Cl3NO2Molecular Weight: 290.529840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: IZQGELJKDARDMZ-UHFFFAOYSA-N

• 4-Chloro-2,6-dimethylpyrimidine
IUPAC Name: 4-chloro-6-methylpyrimidin-2-amine | CAS Registry Number: 5600-21-5
Synonyms: AM (inhibitor), AM (pesticide), prepn. AM, AM (nitrification inhibitor), MLS000389365, 2-AMINO-4-CHLORO-6-METHYLPYRIMIDINE, 2-Pyrimidinamine, 4-chloro-6-methyl-, 122882_ALDRICH, NSC 7892, 4-chloro-6-methylpyrimidin-2-amine, EINECS 227-018-3, NSC7892, NSC 23661, 4-Chloro-6-methylpyrimidin-2-ylamine, AIDS020790, Pyrimidine, 2-amino-4-chloro-6-methyl-, AIDS-020790, NSC23661, BRN 0114297, 2-Amino-6-chloro-4-methylpyrimidine

Molecular Formula: C5H6ClN3Molecular Weight: 143.574240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: NPTGVVKPLWFPPX-UHFFFAOYSA-N

• 5-Chloro-2-hydroxybenzophenone
IUPAC Name: (5-chloro-2-hydroxyphenyl)-phenylmethanone | CAS Registry Number: 85-19-8
Synonyms: Benzophenone-7, Dow Hcb, UV Absorber nl/5, 2-Benzoyl-4-chlorophenol, 2-Hydroxy-5-chlorobenzophenone, 3-Chloro-6-hydroxybenzophenone, C44702_ALDRICH, CHLOROHYDROXY BENZOPHENONE, Benzophenone, 5-chloro-2-hydroxy-, HSDB 2765, CID6799, NSC33407, EINECS 201-592-5, NSC 33407, ZINC00136128, (5-Chloro-2-hydroxyphenyl)phenylmethanone, Methanone, (5-chloro-2-hydroxyphenyl)phenyl-, ST029239, Benzophenone, 5-chloro-2-hydroxy- (8CI), TL8005573

Molecular Formula: C13H9ClO2Molecular Weight: 232.662360 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OMWSZDODENFLSV-UHFFFAOYSA-N

• 1,1,2,2-Tetrachloroethane
IUPAC Name: 1,1,2,2-tetrachloroethane | CAS Registry Number: 79-34-5
Synonyms: s-Tetrachloroethane, Bonoform, Cellon, Tetrachlorethane, Tetrachloroethane, Acetosal, Westron, Acetylene tetrachloride, Acetosol, TCE (ambiguous), sym-Tetrachloroethane, Caswell No. 826, 1,1,2,2-TETRACHLOROETHANE, Ethane, 1,1,2,2-tetrachloro-, Tetrachloroethane (VAN), RCRA waste no. U209, WLN: GYGYGG, RCRA waste number U209, Tetrachlorure d'acetylene, 1,1,2,2-Tetrachloraethan

Molecular Formula: C2H2Cl4Molecular Weight: 167.849280 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: QPFMBZIOSGYJDE-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

• 2,3-Dichlorobenzeneboronic acid
IUPAC Name: (2,3-dichlorophenyl)boronic acid | CAS Registry Number: 151169-74-3
Synonyms: 2,3-Dichlorophenylboronic acid, 2,3-Dichlorobenzeneboronic Acid, (2,3-dichlorophenyl)boronic Acid, (2,3-Dichlorophenyl)Boranediol, AG-D-98033, PubChem1810, SureCN4991, ACMC-1C0UR, AC1MC1N2, KSC174K9P, 514047_ALDRICH, 2,3-dichlorophenyl boronic acid, 2,3-Dichlorophenylboronic acid,, CTK0H4597, 2,3-dichloro phenyl boronic acid, MolPort-000-931-555, AC1Q7137, ACT11128, ANW-21326, AKOS004116112

Molecular Formula: C6H5BCl2O2Molecular Weight: 190.819700 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: TYIKXPOMOYDGCS-UHFFFAOYSA-N

• (R)-Tetrahydrofurfurylamine
IUPAC Name: [(2R)-oxolan-2-yl]methanamine | CAS Registry Number: 7202-43-9
Synonyms: (R)-(-)-Tetrahydrofurfurylamine, (R)-2-(Aminomethyl)tetrahydrofuran, (R)-(tetrahydrofuran-2-yl)methanamine, PubChem7001, R-Tetrahydrofurfurylamine, AC1MC0ET, SureCN226121, (R)-tetrahydrofurfurylamine, Ambcb4036792, (2R)-oxolan-2-ylmethanamine, 412937_ALDRICH, AC1Q50F4, [(2R)-oxolan-2-yl]methanamine, MolPort-001-791-947, ANW-36143, RW3007, AKOS015836399, AM81808, LS30245, RP18742

Molecular Formula: C5H11NOMolecular Weight: 101.146940 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YNOGYQAEJGADFJ-RXMQYKEDSA-N

• 1-Methyl-1H-pyrazol-3-ylamine
IUPAC Name: 1-methylpyrazol-3-amine | CAS Registry Number: 1904-31-0
Synonyms: 1-Methyl-3-aminopyrazole, 1-methyl-1H-pyrazol-3-amine, ZINC02565745, ALBB-004727, CID137254, STK312377, TL8001553

Molecular Formula: C4H7N3Molecular Weight: 97.118480 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: MOGQNVSKBCVIPW-UHFFFAOYSA-N

• (4S)-3-[5-(4-Fluorophenyl)-1,5-dioxopenyl]-4-phenyl-2-oxazolidinone
IUPAC Name: 1-(4-fluorophenyl)-5-[(4S)-2-oxo-4-phenyl-1,3-oxazolidin-3-yl]pentane-1,5-dione | CAS Registry Number: 189028-93-1
Synonyms: 3-[5-(4-fluorophenyl)-1,5-dioxopentyl]-4-phenyl-(4S)-2-oxazolidinone, (S)-1-(4-Fluorophenyl)-5-(2-oxo-4-phenyloxazolidin-3-yl)pentane-1,5-dione, Ezetimibe Intermediate-5, SureCN1177723, Jsp003882, CTK4D9991, MolPort-005-940-270, ACT07247, AMX10118, ANW-44831, SC3731, ZINC21999755, AKOS015896147, AC-1649, AG-E-37893, RL02399, AK-23669, KB-51840, FT-0648270, ST51053181

Molecular Formula: C20H18FNO4Molecular Weight: 355.359623 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: XXSSRSVXDNUAQX-QGZVFWFLSA-N

• 1,1'-(Azodicarbonyl)dipiperidine
IUPAC Name: (NE)-N-(piperidine-1-carbonylimino)piperidine-1-carboxamide | CAS Registry Number: 10465-81-3
Synonyms: AdDP, Azodicarboxylic dipiperidide, 255920_ALDRICH, Azodicarboxylic acid dipiperidide, 11632_FLUKA, AIDS030613, AIDS-030613, NSC356027, NSC 356027, Piperidine, 1,1'-(azodicarbonyl)bis-, SR 4077, SR-4077, Piperidine, 1,1'-[azobis(carbonyl)]bis-, Diazenedicarboxylic acid bis(N,N-piperidide), ADD

Molecular Formula: C12H20N4O2Molecular Weight: 252.312800 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: OQJBFFCUFALWQL-BUHFOSPRSA-N

• 1-(3-Sulfophenyl)-3-methyl-5-pyrazolone
IUPAC Name: 3-(3-methyl-5-oxo-4H-pyrazol-1-yl)benzenesulfonic acid | CAS Registry Number: 119-17-5
Synonyms: 556890_ALDRICH, NSC50668, CID67060, NSC15354, EINECS 204-303-0, NSC 15354, 1-(3-Sulfophenyl)-3-methyl-2-pyrazolin-5-one, 1-(m-SULFOPHENYL)-3-METHYL-5-PYRAZOLONE, TECH, Benzenesulfonic acid, 3-(4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)-, Benzenesulfonic acid, m-(3-methyl-5-oxo-2-pyrazolin-1-yl)-, Benzenesulfonic acid, m-(3-methyl-5-oxo-2-pyrazolin-1-yl)- (8CI), m-(4,5-Dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl)benzenesulphonic acid, 123633-48-7

Molecular Formula: C10H10N2O4SMolecular Weight: 254.262400 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: VEMGKBUHUTYHHA-UHFFFAOYSA-N

• 2-Cyaniminothiazolidine
IUPAC Name: 4,5-dihydro-1,3-thiazol-2-ylcyanamide | CAS Registry Number: 26364-65-8
Synonyms: 2-Cyanoimino-1,3-thiazolidine, 4,5-dihydro-1,3-thiazol-2-ylcyanamide, 2-(Cyanoimino)thiazolidine, PubChem13590, AC1MV1NH, Jsp005183, CTK8B4352, 4,5-dihydrothiazol-2-ylcyanamide, MolPort-002-887-816, (Z)-thiazolidin-2-ylidene-cyanamide, AC-287, ANW-44793, BD2289, AKOS006276470, N-(1,3-thiazolan-2-yliden)cyanamide, MCULE-4571931190, MS-3389, AK-34441, FT-0638596, M-3479

Molecular Formula: C4H5N3SMolecular Weight: 127.167600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: WTUAWWLVVCGTRG-UHFFFAOYSA-N

• 4,5-Dichloro-2-octyl-3(2H)-isothiazolone
IUPAC Name: 4,5-dichloro-2-octyl-1,2-thiazol-3-one | CAS Registry Number: 64359-81-5
Synonyms: Kathon 930, Caswell No. 314B, Anti-Foulant C-9211M, Sea Nine - 211, C11H17Cl2NOS, EINECS 264-843-8, EPA Pesticide Chemical Code 128101, 4,5-Dichloro-2-octyl-2H-isothiazol-3-one, Dichloro-2-n-octyl-3(2H)-isothiazolone, LS-86323, 3(2H)-Isothiazolone, 4,5-dichloro-2-octyl-, 4,5-Dichloro-2-n-octyl-3(2H)-isothiazolone, 4,5-Dichloro-2-n-octyl-4-isothiazolin-3-one

Molecular Formula: C11H17Cl2NOSMolecular Weight: 282.229780 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PORQOHRXAJJKGK-UHFFFAOYSA-N

• 2-Methoxy-5-Methyl-Y-Phenyl
IUPAC Name: 3-(2-methoxy-5-methylphenyl)-3-phenylpropan-1-ol | CAS Registry Number: 124937-73-1
Synonyms: 3-(2-Methoxy-5-methylphenyl)-3-phenyl propanol, 3-(2-Methoxy-5-methylphenyl)-3-phenylpropanol, 3-(2-Methoxy-5-methylphenyl)-3-phenylpropan-1-ol, ACMC-20a6fd, SureCN615095, 3-(2-methoxy-5-methyl-phenyl)-3-phenyl-propan-1-ol, Jsp001636, Jsp001640, CTK0H4365, MolPort-003-986-337, ACT04372, ANW-59255, AKOS015889798, AC-3468, AG-A-50518, AG-D-52857, AK-40881, H698, KB-177422, TL8000650

Molecular Formula: C17H20O2Molecular Weight: 256.339500 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: OCGTUTJXBDQGKL-UHFFFAOYSA-N

• 2-Indanone oxime
IUPAC Name: N-(1,3-dihydroinden-2-ylidene)hydroxylamine | CAS Registry Number: 3349-63-1
Synonyms: 2-Indanone, oxime, NCIOpen2_000087, 415472_ALDRICH, 1,3-Dihydro-2H-inden-2-one oxime, MolPort-000-882-244, 2H-Inden-2-one, 1,3-dihydro-, oxime, CID76875, NSC54456, NSC62556, EINECS 222-105-2, NSC 54456, NSC 62556, ZINC04655281, BBV-181849, C14639, I01-2658

Molecular Formula: C9H9NOMolecular Weight: 147.173860 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: UJLFLOAXKVGYIA-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

• 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

• 2-Aminomethyl-phenylacetic acid
IUPAC Name: 2-[2-(aminomethyl)phenyl]acetic acid | CAS Registry Number: 40851-65-8
Synonyms: 2-Aminomethylphenylacetic acid, (2-(Aminomethyl)phenyl)acetic acid, EINECS 255-110-3, TL8002967

Molecular Formula: C9H11NO2Molecular Weight: 165.189140 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: VLOIVYPDUSVCLZ-UHFFFAOYSA-N

• 2,4-Dichlorothiazole
IUPAC Name: 2,4-dichloro-1,3-thiazole | CAS Registry Number: 4175-76-2
Synonyms: 2,4-dichloro-1,3-thiazole, 2,4-Dichloro-thiazole, dichlorothiazole, ACMC-1ALBT, SureCN149587, AC1Q3KS4, KSC235O9B, CTK1D5790, MolPort-002-471-879, ANW-29670, SBB086954, ZINC08939671, AKOS005072743, AG-F-48504, FD-0206, MCULE-3625040467, RP10083, AK-23570, BR-23570, KB-17484

Molecular Formula: C3HCl2NSMolecular Weight: 154.017740 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: ICETWLGKJXCIDX-UHFFFAOYSA-N

• 3-Chlorobenzisothiazole
IUPAC Name: 3-chloro-1,2-benzothiazole | CAS Registry Number: 7716-66-7
Synonyms: 3-Chloro-1,2-benzisothiazole, 1,2-Benzisothiazole, 3-chloro-, ZINC02380704, CID598190, ST5408344, TL8005303, AA-516/25012032

Molecular Formula: C7H4ClNSMolecular Weight: 169.631360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: BCPVKLRBQLRWDQ-UHFFFAOYSA-N

• 1H-Imidazole-1-acetic acid monohydrochloride
IUPAC Name: 2-imidazol-1-ylacetic acid;hydrochloride | CAS Registry Number: 87266-37-3
Synonyms: 1H-Imidazole-1-acetic acid hydrochloride, 2-(1H-imidazol-1-yl)acetic acid hydrochloride, SBB065721, 1H-imidazol-1-ylacetic acid hydrochloride, 1H-Imidazole-1-aceticacid,monohydrochloride, Acetic acid, 2-(1H-imidazol-1-yl) hydrochloride, (1H-Imidazol-1-yl)-acetic acid, zlchem 363, PubChem7609, PubChem8383, AC1Q3F0H, AGN-PC-00KLV9, SureCN1904485, CTK3F0738, 1H-Imidazole-1-acetic acid HCl, ZLC0207, MolPort-003-848-154, ANW-59999, AKOS015892557, Imidazol-1-ylacetic acid hydrochloride

Molecular Formula: C5H7ClN2O2Molecular Weight: 162.574280 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: JKZJSYXGKHQHRA-UHFFFAOYSA-N

• 2,5-dibromothiophene
IUPAC Name: 2,5-dibromothiophene | CAS Registry Number: 3141-27-3
Synonyms: 2,5-DIBROMOTHIOPHENE, Thiophene, 2,5-dibromo-, NSC4488, 108472_ALDRICH, CID18453, NSC 4488, EINECS 221-547-3, ZINC01673411, AI3-08106, ST5406255, TL8002401, InChI=1/C4H2Br2S/c5-3-1-2-4(6)7-3/h1-2

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

InChIKey: KBVDUUXRXJTAJC-UHFFFAOYSA-N


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