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APAC Pharmaceutical, LLC

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Contact: Andy Yao
Web: http://www.apacpharma.com
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Profile: APAC Pharmaceutical, LLC is a custom chemical and cGMP manufacturing company. We provide chemistry & manufacturing solutions for specialty chemical, pharmaceutical and bio-tech companies. Our specialty product lines are specialty intermediates, metabolites, research reference standards, and drug like compound libraries. These products represent highly characterized compounds of drug substances, impurities, degradation products, metabolites and performance calibrators. Our products include fondaparinux sodium, 2,3,0-(3-pentylidene)-d-gluceraldhyde, 4, 4 -difluoro-cyclohexane carboxylic acid, 1,3,5-tris[(3,3,3-trifluoropropyl)methyl]cyclotrisiloxane, (s)-(-)-4-benzyl-2-oxazolidinone, d-(-)-2-aminobutylic acid, and (r)-tert-butanesulfinamide. We are also specialized in the research and production of synthetic peptides. We develop and manufacture custom peptides & custom cGMP peptides. We have a wide range of modified peptides such as those with unnatural amino acid, phosphorylation, terminal modifications and cyclization. We specialize in the modification of nucleosides and nucleotides. We offer a variety of modified and non-modified nucleoside/nucleotide as well as their analogs. We manufacture a variety of aromatic and unsaturated N, O, S heterocyclic ring including heteroaromatic synthons, complex heterocyclic systems & novel heteroaromatic compounds.

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• 4-(Bromomethyl)biphenyl
IUPAC Name: 1-(bromomethyl)-4-phenylbenzene | CAS Registry Number: 2567-29-5
Synonyms: Biphenyl, 4-(bromomethyl)-, NSC86143, CID257716, SL-00602

Molecular Formula: C13H11BrMolecular Weight: 247.130440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: HZQLUIZFUXNFHK-UHFFFAOYSA-N

• 2,6-Dimethyl-4-Heptanone
IUPAC Name: 2,6-dimethylheptan-4-one | CAS Registry Number: 108-83-8
Synonyms: Isovalerone, Isobutyl ketone, Valerone, Diisobutylketone, DIISOBUTYL KETONE, Diisobutylketon, DIBK, s-Diisopropylacetone, Diisobutilchetone, Di-isobutylcetone, 4-Heptanone, 2,6-dimethyl-, C9-Ketones, 2,6-Dimethyl-4-heptanone, 2,6-Dimethylheptan-4-one, sym-Diisopropylacetone, 2,6-Dimethylheptanone, sec-Diisopropyl acetone, Caswell No. 355B, Ketones, C9-branched, Di-isobutylcetone [French]

Molecular Formula: C9H18OMolecular Weight: 142.238620 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: PTTPXKJBFFKCEK-UHFFFAOYSA-N

• 2-methyl-oxazole-4-carbaldehyde
IUPAC Name: 2-methyl-1,3-oxazole-4-carbaldehyde | CAS Registry Number: 113732-84-6
Synonyms: 2-Methyloxazole-4-carbaldehyde, 2-Methyl-oxazole-4-carbaldehyde, 2-methyl-1,3-oxazole-4-carbaldehyde, 2-methyl-4-formyloxazole, 2-methyloxazole-4-carboxaldehyde, 2-methyl-1,3-oxazole-4-carboxaldehyde, 4-Formyl-2-methyl-1,3-oxazole, 4-oxazolecarboxaldehyde, 2-methyl-, ACMC-20ai0d, 4-Oxazolecarbaldehyde,2-methyl-, CTK4A8416, 4-Oxazolecarboxaldehyde,2-methyl-, ANW-74267, WTI-10627, ZINC20443727, AKOS000111393, AB13940, AG-D-33706, CC57904, RP00517

Molecular Formula: C5H5NO2Molecular Weight: 111.098700 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: ARAUEWKXKTYCHZ-UHFFFAOYSA-N

• 3,5-Dimethoxybenzoyl Hydrazine
IUPAC Name: 3,5-dimethoxybenzohydrazide | CAS Registry Number: 51707-38-1
Synonyms: 3,5-Dimethoxybenzoylhydrazine, AIDS018528, AIDS-018528, 3,5-Dimethoxybenzoic acid hydrazide, NSC525793, STK281624, ZINC00394889, 3,5-Dimethoxybenzoic acid, hydrazide, 3,5-DIMETHOXYBENZOIC HYDRAZIDE, Benzoic acid, 3,5-dimethoxy hydrazide, TL8003420

Molecular Formula: C9H12N2O3Molecular Weight: 196.203180 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: DOWVACHORBOSEF-UHFFFAOYSA-N

• 3-Bromocamphor
IUPAC Name: 3-bromo-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one | CAS Registry Number: 76-29-9
Synonyms: Camphor bromide, (+)-3-Bromocamphor, 3-Bromo-d-camphor, 3-Bromo-2-bornanone, d-alpha-Bromocamphor, 3-Bromobornan-2-one, Camphor, 3-bromo-, d-.alpha.-Bromocamphor, Camphor, 3-bromo-, d-, 2-Bornanone, 3-bromo-, CAMPHOR, MONOBROMATED, Camphor, 3-bromo- (6CI), ARONIS005280, Camphor, 3-alpha-bromo-, (+)-, STOCK2S-11038, Camphor, monobromated [USP IX], EINECS 200-950-8, EINECS 233-652-1, ((1R)-endo)-(+)-3-Bromocamphor, NSC 26355

Molecular Formula: C10H15BrOMolecular Weight: 231.129500 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: NJQADTYRAYFBJN-UHFFFAOYSA-N

• 1-(2'-Hydroxyethyl)-2,2,6,6-tetramethyl-4-piperidine
IUPAC Name: 1-(2-hydroxyethyl)-2,2,6,6-tetramethylpiperidin-4-ol | CAS Registry Number: 52722-86-8
Synonyms: EINECS 258-132-1, ZERO/009337, CID104301, 4-Hydroxy-2,2,6,6-tetramethylpiperidine-1-ethanol, 1-Piperidineethanol, 4-hydroxy-2,2,6,6-tetramethyl-, 1-(2-Hydroxyethyl)-4-hydroxy-2,2,6,6-tetramethylpiperidine, 116543-66-9, 117247-95-7

Molecular Formula: C11H23NO2Molecular Weight: 201.305820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: STEYNUVPFMIUOY-UHFFFAOYSA-N

• 2,5-Dibromo-3-methylpyridine
IUPAC Name: 2,5-dibromo-3-methylpyridine | CAS Registry Number: 3430-18-0
Synonyms: 2,5-Dibromo-3-picoline, 637661_ALDRICH, 652865_ALDRICH, ZINC00331806, CID817680, SBB003143, TL8002556, AC-907/30003010

Molecular Formula: C6H5Br2NMolecular Weight: 250.918600 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: LIMXEVCFAUTBCK-UHFFFAOYSA-N

• 2-Methoxy-5-nitrophenol
IUPAC Name: 2-methoxy-5-nitrophenol | CAS Registry Number: 636-93-1
Synonyms: 5-Nitroguaiacol, ghl.PD_Mitscher_leg0.1131, 329274_ALDRICH, 3-Hydroxy-4-methoxynitrobenzene, 65136_FLUKA, EINECS 211-269-0, ZINC00295034, ST5408114, TL8004458, InChI=1/C7H7NO4/c1-12-7-3-2-5(8(10)11)4-6(7)9/h2-4,9H,1H

Molecular Formula: C7H7NO4Molecular Weight: 169.134780 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: KXKCTSZYNCDFFG-UHFFFAOYSA-N

• 3 - Acetyl-2-Amino Pyridine
IUPAC Name: 1-(2-aminopyridin-3-yl)ethanone | CAS Registry Number: 65326-33-2
Synonyms: 2-AMINO-3-ACETYLPYRIDINE, 1-(2-aminopyridin-3-yl)ethanone, 3-Acetyl-2-aminopyridine, 1-(2-aminopyridin-3-yl)ethan-1-one, SBB065617, AG-G-45836, aminopyridinylethanone, PubChem18534, 2-Amino-3-Acetyl pyridine, SureCN1322157, 3-ACETYLPYRIDIN-2-AMINE, CTK5C2559, MolPort-001-758-288, ACT07685, ANW-74324, ZINC19851162, Ethanone,1-(2-amino-3-pyridinyl)-, AKOS005072803, 1-(2-Amino-3-pyridinyl)-1-ethanone, AB11689

Molecular Formula: C7H8N2OMolecular Weight: 136.151220 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BNVLGAQNNFJKHG-UHFFFAOYSA-N

• 2-Methyl-3-Aminobenzoic Acid
IUPAC Name: 3-amino-2-methylbenzoate | CAS Registry Number: 52130-17-3
Synonyms: 2-methyl-3-aminobenzoic acid, TPC-I004, ZINC00389566, CID6950343

Molecular Formula: C8H8NO2-Molecular Weight: 150.154620 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BYHMLZGICSEKIY-UHFFFAOYSA-M

• 4-bromo-6-methoxy-1h-indole
IUPAC Name: 4-bromo-6-methoxy-1H-indole | CAS Registry Number: 393553-55-4
Synonyms: 4-bromo-6-methoxy-1H-indole, 4-Bromo-6-methoxyindole, 4-Bromo-6-methoxyindole;, SureCN2214501, 1H-Indole,4-bromo-6-methoxy-, CTK4I1286, MolPort-005-932-979, ANW-73056, ZINC02384056, AKOS015960566, AB13576, AG-F-39068, AC-11489, AK109107, KB-37285, QC-10480, A18725

Molecular Formula: C9H8BrNOMolecular Weight: 226.069920 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: CZJYKEPYJHPVOD-UHFFFAOYSA-N

• 3-Chloro-4-Fluorobromobenzene
IUPAC Name: 4-bromo-2-chloro-1-fluorobenzene | CAS Registry Number: 60811-21-4
Synonyms: 4-Bromo-2-chloro-1-fluorobenzene, 3-chloro-4-fluorobromobenzene, 1-Bromo-3-chloro-4-fluorobenzene, 3-Chloro-4-fluorobenzene bromide, 4-Bromo-2-chlorofluorobenzene, ST50408594, PubChem2169, ACMC-209mma, AC1MT0NM, SureCN330695, KSC493O4N, 4-bromo-2-chloro-fluorobenzene, 432229_ALDRICH, CTK3J3746, MolPort-000-151-812, OTAVA-BB 1287445, AKOS 91987, ACT12570, 3-Chloro-4-fluorobromobenzene 98%, ANW-33584

Molecular Formula: C6H3BrClFMolecular Weight: 209.443423 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: CJTIWGBQCVYTQE-UHFFFAOYSA-N

• 3-Trifluoromethyl Benzyl Chloride
IUPAC Name: 1-(chloromethyl)-3-(trifluoromethyl)benzene | CAS Registry Number: 705-29-3
Synonyms: 3-(Chloromethyl)benzotrifluoride, 3-(Trifluoromethyl)benzyl chloride, m-Trifluoromethylbenzyl chloride, 167703_ALDRICH, 3-Trifluoromethylbenzyl chloride, NSC5227, m-(Trifluoromethyl)benzyl chloride, JRD-0235, NSC 5227, EINECS 211-884-4, alpha-Chloro-3-trifluoromethyltoluene, Benzene, 1-(chloromethyl)-3-(trifluoromethyl)-, .alpha.-Chloro-3-trifluoromethyltoluene, 1-(Chloromethyl)-3-(trifluoromethyl)benzene, ST5214171, TL8004976, alpha'-Chloro-alpha,alpha,alpha-trifluoro-m-xylene, .alpha.'-Chloro-.alpha.,.alpha.,.alpha.-trifluoro-m-xylene, m-Xylene, alpha'-chloro-alpha,alpha,alpha-trifluoro-, m-Xylene, .alpha.'-chloro-.alpha.,.alpha.,.alpha.-trifluoro-

Molecular Formula: C8H6ClF3Molecular Weight: 194.581450 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: XGASTRVQNVVYIZ-UHFFFAOYSA-N

• 3,4-Dimethoxyphenethylamine
IUPAC Name: 2-(3,4-dimethoxyphenyl)ethanamine | CAS Registry Number: 120-20-7
Synonyms: Homoveratrylamine, Dimethoxydopamine, Dimethylmescaline, DIMPEA, DMPEA, Dimethoxyphenylethylamine, 3,4-Dimethoxydopamine, Dopamine dimethyl ether, O,O-Dimethyldopamine, DMPE, 3,4-Dimethoxyphenylethylamine, 3,4-Di-O-methyldopamine, Benzeneethanamine, 3,4-dimethoxy-, 3,4-Dimethoxybenzeneethanamine, 2-(3,4-Dimethoxyphenyl)ethylamine, NCIOpen2_005995, Oprea1_397610, PHENETHYLAMINE, 3,4-DIMETHOXY-, MLS000515889, 3,4-Dimethoxyphenylethylamine(base)

Molecular Formula: C10H15NO2Molecular Weight: 181.231600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ANOUKFYBOAKOIR-UHFFFAOYSA-N

• 4-Fluoro-2-nitroaniline
IUPAC Name: 4-fluoro-2-nitroaniline | CAS Registry Number: 364-78-3
Synonyms: Benzenamine, 4-fluoro-2-nitro-, 4-Fluoro-2-nitrophenylamine, 162558_ALDRICH, NSC402980, CID67769, EINECS 206-666-0, SBB016897, ZINC04261952, TL8002692

Molecular Formula: C6H5FN2O2Molecular Weight: 156.114503 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: PUGDHSSOXPHLPT-UHFFFAOYSA-N

• 2-Chloro-5-trichloromethylpyridine
IUPAC Name: 2-chloro-5-(trichloromethyl)pyridine | CAS Registry Number: 69045-78-9
Synonyms: ZINC00226188, 2-chloro-5-(trichloromethyl)pyridine, Pyridine, 2-chloro-5-(trichloromethyl)-, 2-CHLORO-5-TRICHLOROMETHYLPYRIDINE, ST5036736, EU-0033517

Molecular Formula: C6H3Cl4NMolecular Weight: 230.906720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VLJIVLGVKMTBOD-UHFFFAOYSA-N

• 4-Amino-3-methoxyazobene-3'-sulfonic acid sodium salt
IUPAC Name: (E)-3-(5-bromo-2-methoxyphenyl)-N-(6-methyl-2-phenylbenzotriazol-5-yl)prop-2-enamide | CAS Registry Number: 6300-07-8
Synonyms: STOCK3S-55001, MolPort-000-810-938, STK083932, ZINC01185643, CID1348401, 3-(5-bromo-2-methoxy-phenyl)-N-(6-methyl-2-phenyl-benzotriazol-5-yl)prop-2-enamide, (2E)-3-(5-bromo-2-methoxyphenyl)-N-(6-methyl-2-phenyl-2H-benzotriazol-5-yl)prop-2-enamide

Molecular Formula: C23H19BrN4O2Molecular Weight: 463.326560 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: PWJJPLSGNXAVBZ-DHZHZOJOSA-N

• 2-Methylindole
IUPAC Name: 2-methyl-1H-indole | CAS Registry Number: 95-20-5
Synonyms: 2-METHYLINDOLE, 2-Methyl-1H-indole, Indole, 2-methyl-, 1H-Indole, 2-methyl-, M51407_ALDRICH, Indole, 2-methyl- (8CI), ARONIS020142, NSC 7514, EINECS 202-398-3, NSC7514, ZINC01088076, AI3-03945, LS-83246, LS-83247, ST040425, TL8005985, M-3895, InChI=1/C9H9N/c1-7-6-8-4-2-3-5-9(8)10-7/h2-6,10H,1H, 2MI

Molecular Formula: C9H9NMolecular Weight: 131.174460 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BHNHHSOHWZKFOX-UHFFFAOYSA-N

• 3,5 - Diamino-2,4,6-Trimethyl Benzene Sulfonic Acid
IUPAC Name: 3,5-diamino-2,4,6-trimethylbenzenesulfonic acid | CAS Registry Number: 32432-55-6
Synonyms: Diaminomesitylenesulfonic acid, EINECS 251-039-7, CID94430, BRN 3323474, LS-31851, 3,5-Diamino-2,4,6-trimethylbenzenesulfonic acid, 3,5-Diamino-2,4,6-trimethylbenzenesulphonic acid, Benzenesulfonic acid, 3,5-diamino-2,4,6-trimethyl-, 2-14-00-00453 (Beilstein Handbook Reference)

Molecular Formula: C9H14N2O3SMolecular Weight: 230.284060 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 5

InChIKey: PKKGGWLTUCMSSD-UHFFFAOYSA-N

• 4-Bromo-3-Methyl-2-Thiophenecarbonyl Chloride
IUPAC Name: 4-bromo-3-methylthiophene-2-carbonyl chloride | CAS Registry Number: 265652-36-6
Synonyms: 4-bromo-3-methyl-2-thiophenecarbonyl chloride, 4-bromo-3-methylthiophene-2-carboxylic acidchloride, 4-bromo-3-methylthiophenecarbonyl chloride, 4-bromo-3-methylthiophene-2-carbonyl chloride, 4-bromo-3-methylthiophenecarboxylic acid chloride, ZINC02507128, PubChem5266, AC1MBV0W, CTK4F8155, AKOS015960596, AB13922, AG-E-83780, QC-6061, 4-bromanyl-3-methyl-thiophene-2-carbonyl chloride, A818511, 4-Bromo-3-methyl-thiophene-2-carboxylic acid chloride, 4-bromo-3-methyl-thiophene-2-carboxylic acidchloride, 4-bromo-3-methylthiophene-2-carboxylic acid chloride

Molecular Formula: C6H4BrClOSMolecular Weight: 239.517360 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: LQDVGTOWGBSXPJ-UHFFFAOYSA-N

• 4-Methyl-5-Hydroxyethyl Thiazole
IUPAC Name: 2-(4-methyl-1,3-thiazol-5-yl)ethanol | CAS Registry Number: 137-00-8
Synonyms: Hemineurine, sulfurol, Thiamine thiazole, 5-Thiazoleethanol, 4-methyl-, 4-Methyl-5-thiazolethanol, 4-Methyl-5-hydroxyethylthiazole, 4-METHYL-5-THIAZOLEETHANOL, 5-(2-Hydroxyethyl)-4-methylthiazole, MHT (VAN), 4-Methyl-5-thiazolylethanol, W320404_ALDRICH, 4-Methyl-5-hydroxethylthiazole, FEMA No. 3204, 190675_ALDRICH, 2-(4-Methylthiazol-5-yl)ethanol, 4-methyl-5-(2-hydroxyethyl)-thiazole, NChemBio.2007.13-comp11, CHEBI:17957, CID1136, 4-Methyl-5-(2-hydroxyethyl)thiazole

Molecular Formula: C6H9NOSMolecular Weight: 143.206760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: BKAWJIRCKVUVED-UHFFFAOYSA-N

• 3,5-Dihydroxy-A-Bromoacetophenone
IUPAC Name: 2-bromo-1-(3,5-dihydroxyphenyl)ethanone | CAS Registry Number: 62932-92-7
Synonyms: 2-bromo-1-(3,5-dihydroxyphenyl)ethanone, 3',5'-Dihydroxyphenacyl bromide, 3,5-Dihydroxy-alfa-bromoacetophenone, ZINC02507126, zlchem 1042, AC1MBUOV, CTK5B6704, ZLD0508, AKOS015960607, AB13915, AG-G-32108, KB-168651, Ethanone,2-bromo-1-(3,5-dihydroxyphenyl)-, FT-0640857, 1-[3,5-bis(oxidanyl)phenyl]-2-bromanyl-ethanone, A834099, 2-BROMO-1-(3,5-DIHYDROXYPHENYL)ETHAN-1-ONE, ETHANONE, 2-BROMO-1-(3,5-DIHYDROXYPHENYL)-, 2-Bromo-1-(3,5-dihydroxyphenyl)ethanone;3,5-Dihydroxy-A'A|AfA-bromoacetophenone;3',5'-Dihydroxyphenacyl bromide;

Molecular Formula: C8H7BrO3Molecular Weight: 231.043380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: WUXKAYZEXYAYIT-UHFFFAOYSA-N

• 5-Methylisoxazole-4-carboxylic acid
IUPAC Name: 5-methyl-1,2-oxazole-4-carboxylic acid | CAS Registry Number: 42831-50-5
Synonyms: 633771_ALDRICH, ALBB-005390, SBB005909, M2622G1, TL8003034

Molecular Formula: C5H5NO3Molecular Weight: 127.098100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: VQBXUKGMJCPBMF-UHFFFAOYSA-N

• 2-Amino-4-(1,1-dimethylbutyl)-6-nitrophenol
IUPAC Name: 2-amino-4-(2-methylbutan-2-yl)-6-nitrophenol | CAS Registry Number: 83488-02-2
Synonyms: EINECS 280-465-6, CID5743751, 2-Amino-6-nitro-4-(tert-pentyl)phenol

Molecular Formula: C11H16N2O3Molecular Weight: 224.256340 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: WLJLENRIPLYJSZ-UHFFFAOYSA-N

• 4,4'-Azoxydiphenetole
IUPAC Name: (4-ethoxyphenyl)-(4-ethoxyphenyl)imino-oxidoazanium | CAS Registry Number: 4792-83-0
Synonyms: Azoxyphenetole, p-Azoxyphenetol, p,p'-Azoxyphenetole, 4,4'-Azoxyphenetole, Azoxybenzene, 4,4'-diethoxy-, 4,4'-Diethoxyazoxybenzene, Bis-p-ethoxyazoxybenzene, p-AZOXY PHENETOLE, p,p'-Diethyloxyazoxybenzene, p,p'-Diethoxyazoxybenzene, 4,4'-Bis(ethoxy)azoxybenzene, CCRIS 2242, Diazene, bis(4-ethoxyphenyl)-, 1-oxide, NSC142006, Bis(4-ethoxyphenyl)diazene 1-oxide, CID78520, EINECS 225-347-7, STK378390, ZINC04501604, DAH1599101

Molecular Formula: C16H18N2O3Molecular Weight: 286.325720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: QUICZVHSJNKDBL-UHFFFAOYSA-N

• 3-Hydroxy-2-Methylbenzoic Acid
IUPAC Name: 3-hydroxy-2-methylbenzoic acid | CAS Registry Number: 603-80-5
Synonyms: 3,2-Cresotic acid, NCIOpen2_000440, NSC73133, CID252023

Molecular Formula: C8H8O3Molecular Weight: 152.147320 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: RIERSGULWXEJKL-UHFFFAOYSA-N

• 2 - Chloro-P-Phenylenediamine
IUPAC Name: 2-chlorobenzene-1,4-diamine; sulfuric acid | CAS Registry Number: 615-66-7
Synonyms: Fourrine SO, renal brown so, Renal SO, Fourrine 81, 2-Cl-p-PD, C.I. Oxidation Base 13A, CCRIS 145, 2-Chloro-p-phenylenediamine sulfate, 3-Chloro-4-aminoaniline sulfate, HSDB 6247, NCI-C03316, 2-Chloro-p-phenylenediamine SO4, 24240_FLUKA, EINECS 228-291-1, EINECS 262-915-3, 2-Chloro p-phenylenediamine sulphate, 2-chlorobenzene-1,4-diamine sulfate, 2-Chloro-1,4-phenylenediamine sulfate, CID22584, p-Phenylenediamine, 2-chloro-, sulfate

Molecular Formula: C6H9ClN2O4SMolecular Weight: 240.664660 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 6

InChIKey: GQFGHCRXPLROOF-UHFFFAOYSA-N

• 2-Benzoxazolinone
IUPAC Name: 3H-1,3-benzoxazol-2-one | CAS Registry Number: 59-49-4
Synonyms: Benzoxazolone, Benzoxazolinone, 2-BENZOXAZOLINONE, 2-Benzoxazolol, 2(3H)-Benzoxazolone, benzoxazolone-2, 2-Hydroxybenzoxazole, benzoxazolin-2-one, Benzoxazole, 2-hydroxy-, benzoxazolone zinc salt, 3H-benzooxazol-2-one, 2(3H)-Benzoxazolinone, benzoxazolin-2(3H)-one, USAF EK-5429, BENZOXAZOLINE,2-ONE, WLN: T56 BMVOJ, 1,3-Benzoxazol-2(3H)-one, CCRIS 6794, C7H5NO2, MLS000515797

Molecular Formula: C7H5NO2Molecular Weight: 135.120100 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ASSKVPFEZFQQNQ-UHFFFAOYSA-N

• 4-Phenyl-4-HydroxyPiperidine
IUPAC Name: 4-phenylpiperidin-4-ol | CAS Registry Number: 40807-61-2
Synonyms: 4-Phenyl-4-piperidinol, Ambap1663, 4-Phenylpiperidin-4-ol, 4-Hydroxy-4-phenylpiperidine, 4-Piperidinol, 4-phenyl-, H52201_ALDRICH, NSC71658, 56170_FLUKA, CID96387, EINECS 255-089-0, NSC 71658

Molecular Formula: C11H15NOMolecular Weight: 177.242900 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: KQKFQBTWXOGINC-UHFFFAOYSA-N

• 5-Cyanoindole
IUPAC Name: 1H-indole-5-carbonitrile | CAS Registry Number: 15861-24-2
Synonyms: 1H-Indole-5-carbonitrile, INDOLE-5-CARBONITRILE, C92006_ALDRICH, EINECS 239-986-4, SBB004148, ZINC00157017, LS-82429, TL8001198, C-8840, InChI=1/C9H6N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5,11

Molecular Formula: C9H6N2Molecular Weight: 142.157340 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YHYLDEVWYOFIJK-UHFFFAOYSA-N

• 5-Methylisatin
IUPAC Name: 5-methyl-1H-indole-2,3-dione | CAS Registry Number: 608-05-9
Synonyms: Isatin, 5-methyl-, 5-Methyl-indole-2,3-dione, 5-Methyl-1H-indole-2,3-dione, 5-Methylindole-2,3-dione, Isatin-based compound, 30, 1H-Indole-2,3-dione, 5-methyl-, INDOLE-2,3-DIONE, 5-METHYL-, 5-Methylindole-2,3(1H)-dione, Isatin, 5-methyl- (6CI), M3002_SIGMA, 222429_ALDRICH, NSC 9398, EINECS 210-152-1, NSC9398, AIDS163136, AIDS-163136, BRN 0123738, ZINC01699967, LS-83034, 1H-Indole-2,3-dione, 5-methyl- (9CI)

Molecular Formula: C9H7NO2Molecular Weight: 161.157380 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: VAJCSPZKMVQIAP-UHFFFAOYSA-N

• 2,3-Dimethoxybenzonitrile
IUPAC Name: 3,4-dimethoxybenzonitrile | CAS Registry Number: 2024-83-1
Synonyms: Veratronitrile, 3,4-Dimethoxybenzonitrile, 4-Cyanoveratrole, D132306_ALDRICH, 3,4-Dimethoxybenzoic acid nitrile, BENZONITRILE, 3,4-DIMETHOXY-, NSC27016, EINECS 217-969-2, NSC209526, ZINC00336934, ST5214584, AP-065/41884102, 23024-83-1, InChI=1/C9H9NO2/c1-11-8-4-3-7(6-10)5-9(8)12-2/h3-5H,1-2H

Molecular Formula: C9H9NO2Molecular Weight: 163.173260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: OSEQIDSFSBWXRE-UHFFFAOYSA-N

• 6,7-Dimethoxy-L-1,2,3,4-Tetrahydroisoquinoline 3-Carboxylic Acid Hydrochloride
IUPAC Name: (3S)-6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate | CAS Registry Number: 103733-66-0
Synonyms: ZINC00404044, ZINC00404045, CID6951266

Molecular Formula: C12H15NO4Molecular Weight: 237.251800 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: BWYXEHBJIMGDEB-VIFPVBQESA-N

• 5-Nitroindole
IUPAC Name: 5-nitro-1H-indole | CAS Registry Number: 6146-52-7
Synonyms: 5-Nitro-1H-indole, 1H-Indole, 5-nitro-, INDOLE, 5-NITRO-, CCRIS 3255, Oprea1_492280, N17602_ALDRICH, EINECS 228-153-0, 1H-Indole, 5-nitro- (9CI), NSC520594, ZINC00105247, LS-83315, SB 01605, ST5406179, TL8003894, N-3000

Molecular Formula: C8H6N2O2Molecular Weight: 162.145440 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: OZFPSOBLQZPIAV-UHFFFAOYSA-N

• 6-Bromoindazole
IUPAC Name: 6-bromo-1H-indazole | CAS Registry Number: 79762-54-2
Synonyms: 6-bromo-1H-indazole, AG-H-19731, 6- Bromoindazole, PubChem7831, zlchem 1237, SureCN5902, 6-bromanyl-1H-indazole, 6-Bromo-1H-indazole,, 6-Bromo-1H-indazole;, 1H-Indazole, 6-bromo-, ACMC-209pi5, BROMOINDAZOLE(6-), AGN-PC-01MHI9, INDAZOLE, 6-BROMO-, KSC376S4P, 1H-INDAZOLE,6-BROMO-, AC1Q251Y, CHEMBL247365, CTK2H6947, ZLE0012

Molecular Formula: C7H5BrN2Molecular Weight: 197.032000 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: WMKDUJVLNZANRN-UHFFFAOYSA-N

• 2-Amino-5-Fluoro Benzoic Acid
IUPAC Name: 2-amino-5-fluorobenzoic acid | CAS Registry Number: 446-08-2
Synonyms: 5-Fluoroanthranilic acid, 5-fluoroanthranilate, 2-Amino-5-fluorobenzoic acid, 367982_ALDRICH, 07973_FLUKA, ALBB-006133, ALD-N000063, EINECS 207-159-7, CPD0-1487, NSC513308, TL8003110, 3S104446, InChI=1/C7H6FNO2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,9H2,(H,10,11

Molecular Formula: C7H6FNO2Molecular Weight: 155.126443 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: FPQMGQZTBWIHDN-UHFFFAOYSA-N

• 5-Methoxyindole-3-carboxylic acid
IUPAC Name: 5-methoxy-1H-indole-3-carboxylic acid | CAS Registry Number: 10242-01-0
Synonyms: NSC88877, CID259191, 5-Methoxy-1H-indole-3-carboxylic acid, SL-00594

Molecular Formula: C10H9NO3Molecular Weight: 191.183360 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: RVVSEZGJCOAUED-UHFFFAOYSA-N

• 2,6-Difluorobenzaldehyde
IUPAC Name: 2,6-difluorobenzaldehyde | CAS Registry Number: 437-81-0
Synonyms: 265152_ALDRICH, JRD-0120, SBB006685, ZINC02539337, TL806242

Molecular Formula: C7H4F2OMolecular Weight: 142.102866 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: SOWRUJSGHKNOKN-UHFFFAOYSA-N

• 2-Amino-5-chlorobenzoic acid
IUPAC Name: 2-amino-5-chlorobenzoic acid | CAS Registry Number: 635-21-2
Synonyms: 5-Chloroanthranilic acid, Anthranilic acid, 5-chloro-, Benzoic acid, 2-amino-5-chloro-, 2-AMINO-5-CHLOROBENZOIC ACID, 5-Chloro-2-aminobenzoic acid, A45475_ALDRICH, 378046_ALDRICH, 07360_FLUKA, AIDS020040, AIDS-020040, EINECS 211-230-8, NSC404157, SBB016392, Anthranilic acid, 5-chloro- (8CI), NSC 404157, AI3-15229, TL8004430, InChI=1/C7H6ClNO2/c8-4-1-2-6(9)5(3-4)7(10)11/h1-3H,9H2,(H,10,11

Molecular Formula: C7H6ClNO2Molecular Weight: 171.581040 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 3

InChIKey: IFXKXCLVKQVVDI-UHFFFAOYSA-N

• 2-Fluoro Benzotrifluoride
IUPAC Name: 1-fluoro-2-(trifluoromethyl)benzene | CAS Registry Number: 392-85-8
Synonyms: o-Fluorobenzotrifluoride, 2-Fluorobenzotrifluoride, 1-Fluoro-2-(trifluoromethyl)benzene, 219363_ALDRICH, Benzene, 1-fluoro-2-(trifluoromethyl)-, JRD-0087, NSC10314, EINECS 206-880-4, NSC 10314, o,alpha,alpha,alpha-Tetrafluorotoluene, alpha,alpha,alpha,2-Tetrafluorotoluene, alpha,alpha,alpha,Ar-Tetrafluorotoluene, 1-FLUORO-2-TRIFLUOROMETHYLBENZENE, ST5406530, TL8002835, o,.alpha.,.alpha.,.alpha.-Tetrafluorotoluene, Toluene, .alpha.,.alpha.,.alpha.,o-tetrafluoro-, Toluene, o,.alpha.,.alpha.,.alpha.-tetrafluoro-, InChI=1/C7H4F4/c8-6-4-2-1-3-5(6)7(9,10)11/h1-4

Molecular Formula: C7H4F4Molecular Weight: 164.100273 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: BGVGHYOIWIALFF-UHFFFAOYSA-N

• 1,5-Isoquinolinediol
IUPAC Name: 5-hydroxy-2H-isoquinolin-1-one | CAS Registry Number: 5154-02-9
Synonyms: 1,5-isoquinolinediol, 1,5-Dihydroxyisoquinoline, Lopac-I-138, PARP Inhibitor IV, IQD, I138_SIGMA, Lopac0_000655, MLS000860043, 5-Hydroxy-1(2H)-isoquinolinone, 5-Hydroxy-1(2H)-isoquinoline, NSC65585, CID1340, CHEBI:306035, MolPort-003-941-774, 1(2H)-Isoquinolinone, 5-hydroxy-, IN1292, ZINC08616043, SMP2_000192, 5-Hydroxy-2H-isoquinolin-1-one (DHQ), NCGC00015537-01, NCGC00015537-02

Molecular Formula: C9H7NO2Molecular Weight: 161.157380 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 2

InChIKey: LFUJIPVWTMGYDG-UHFFFAOYSA-N

• 1-AdamantaneCarboxylic acid
IUPAC Name: adamantane-1-carboxylic acid | CAS Registry Number: 828-51-3
Synonyms: Adamantoic acid, 1-Carboxyadamantane, 1-Adamantanecarboxylic acid, Adamantanecarboxylic acid, Adamantane-1-carboxylic acid, Enamine_000586, Adamantane-2-carboxylic acid, Oprea1_849468, 106399_ALDRICH, 3-ADAMANTANECARBOXYLIC ACID, 01823_FLUKA, EINECS 212-584-6, NSC 94182, 1-Adamantanecarboxylic acid (8CI), CID13235, NSC94182, SBB015170, AI3-52431, LS-14967, Tricyclo(3.3.1.1'3,7)decane-1-carboxylic acid

Molecular Formula: C11H16O2Molecular Weight: 180.243540 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: JIMXXGFJRDUSRO-UHFFFAOYSA-N

• 2,4-Dimercapto-5,6-Diamino-Pyrimidine
IUPAC Name: 5,6-diamino-1H-pyrimidine-2,4-dithione | CAS Registry Number: 31295-41-7
Synonyms: D15405_ALDRICH, NSC45757, ZINC01081262, 4,5-Diamino-2,6-dimercaptopyrimidine, CID1268115, ST5409771, 5,6-Diamino-2,4(1H,3H)-pyrimidinedithione, 4,5-diamino-6-sulfanyl-2-pyrimidinyl hydrosulfide, AC-907/25014028

Molecular Formula: C4H6N4S2Molecular Weight: 174.247240 [g/mol]
H-Bond Donor: 4H-Bond Acceptor: 2

InChIKey: IQGYCVKWCYGVBK-UHFFFAOYSA-N

• 2,6-Difluorobenzoic Acid
IUPAC Name: 2,6-difluorobenzoic acid | CAS Registry Number: 385-00-2
Synonyms: 2,6-DIFLUOROBENZOIC ACID, Benzoic acid, 2,6-difluoro-, 190039_ALDRICH, EINECS 206-856-3, CID9796, NSC126584, NSC 126584, BRN 0973774, AI3-63060, LS-36968, TL806244, ST5213952, Y16031, 3-09-00-01330 (Beilstein Handbook Reference), InChI=1/C7H4F2O2/c8-4-2-1-3-5(9)6(4)7(10)11/h1-3H,(H,10,11

Molecular Formula: C7H4F2O2Molecular Weight: 158.102266 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: ONOTYLMNTZNAQZ-UHFFFAOYSA-N

• 2,6-Difluorophenol
IUPAC Name: 2,6-difluorophenol | CAS Registry Number: 28177-48-2
Synonyms: Ambap60, Phenol, 2,6-difluoro-, 2,6- Difluorophenol, 2,6-Difluoro-phenol, 264466_ALDRICH, ZINC00388530, CID94392, JRD-0069, EINECS 248-884-9, TL8002242, FFP

Molecular Formula: C6H4F2OMolecular Weight: 130.092166 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CKKOVFGIBXCEIJ-UHFFFAOYSA-N

• 2,6-Dichloro Benzene Sulfonyl Chloride
IUPAC Name: 2,6-dichlorobenzenesulfonyl chloride | CAS Registry Number: 6579-54-0
Synonyms: 2,6-Dichlorobenzenesulfonyl chloride, 2,6-dichlorobenzene-1-sulfonyl chloride, 2,6-Dichlorobenzenesulfonylchloride, 2,6-Dichlorobenzenesulphonyl chloride, SBB055016, 2,6-dichloro-benzenesulfonyl chloride, 2,6-dichlorobenzene sulfonyl chloride, AG-G-47675, PubChem5117, AC1LAWLQ, ACMC-209ns8, DSSTox_CID_29303, DSSTox_RID_83421, DSSTox_GSID_49346, KSC491C3R, 545708_ALDRICH, AC1Q3K70, CTK3J1138, (2,6-dichlorophenyl)chlorosulfone, BUTTPARK 37\11-63

Molecular Formula: C6H3Cl3O2SMolecular Weight: 245.510820 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 2

InChIKey: WGGKQIKICKLWGN-UHFFFAOYSA-N

• 2,4-Difluoro-3-Methoxy Acetophenone
IUPAC Name: 1-(2,4-difluoro-3-methoxyphenyl)ethanone | CAS Registry Number: 373603-19-1
Synonyms: 2',4'-Difluoro-3'-methoxyacetophenone, 2,4-Difluoro-3-methoxy acetophenone, AC1MY3XM, SureCN116280, CTK6J4331, MolPort-000-166-093, 2,4-Difluoro-3-methoxyacetophenone, JRD-1450, SBB090380, ZINC02579308, AKOS015956609, AG-B-83576, 1-acetyl-2,4-difluoro-3-methoxybenzene, 1-(2,4-difluoro-3-methoxyphenyl)ethanone, I14-91049

Molecular Formula: C9H8F2O2Molecular Weight: 186.155426 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: KTZOZLGEZVDGMS-UHFFFAOYSA-N

• 2,3-Dichloro Aniline
IUPAC Name: 2,3-dichloroaniline | CAS Registry Number: 608-27-5
Synonyms: 2,3-DICHLOROANILINE, Dichloroanilines, Aniline, 2,3-dichloro-, Benzenamine, 2,3-dichloro-, 2,3-Dichlorobenzenamine, 2,3-Dichloranilin, DICHLOROANILINE, Ar,ar-dichlorobenzenamine, Benzenamine, ar,ar-dichloro-, D55407_ALDRICH, HSDB 5433, 36701_RIEDEL, 35160_FLUKA, CHEBI:46636, EINECS 210-157-9, NSC 60683, Aniline, 2,3-dichloro- (7CI,8CI), NSC60683, UN1590, ZINC00388504

Molecular Formula: C6H5Cl2NMolecular Weight: 162.016600 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 1

InChIKey: BRPSAOUFIJSKOT-UHFFFAOYSA-N

• 6-Trifluoromethylindole
IUPAC Name: 6-(trifluoromethyl)-1H-indole | CAS Registry Number: 13544-43-9
Synonyms: 6-(Trifluoromethyl)indole, 6-(trifluoromethyl)-1H-indole, 6-Trifluoromethyl-1H-indole, 1H-Indole, 6-(trifluoromethyl)-, ST50408288, ZINC02564310, PubChem1713, AC1MCRRZ, ACMC-1BSCM, 6-Trifluoromethylindole,, SureCN45243, KSC910G4N, RARECHEM AH BS 0129, CTK8B0346, MolPort-000-006-386, ACT02560, ANW-19845, RW1246, SBB090260, WTI-10687

Molecular Formula: C9H6F3NMolecular Weight: 185.145850 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: BPYBYPREOVLFED-UHFFFAOYSA-N

• 3-Amino-4-FluoroBenzotrifluoride
IUPAC Name: 2-fluoro-5-(trifluoromethyl)aniline | CAS Registry Number: 535-52-4
Synonyms: 3-Amino-4-fluorobenzotrifluoride, 2-Fluoro-5-(trifluoromethyl)aniline, 285056_ALDRICH, ALBB-001513, JRD-0384, NSC10327, ZINC01706172, alpha,alpha,alpha,6-Tetrafluoro-m-toluidine, ST5405104, .alpha.,.alpha.,.alpha.,6-Tetrafluoro-m-toluidine

Molecular Formula: C7H5F4NMolecular Weight: 179.114913 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: DRKWGMXFFCPZLW-UHFFFAOYSA-N


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