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Shanghai Record Pharmaceuticals Co., Ltd.

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Web: http://www.recordpharm.com.cn
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Address: No. 799, DunHuang Rd., Shanghai 200331, China
Phone: +86-(21)-6363-8051, 6250-3080, 6250-3083 | Fax: +86-(21)-6363-6419 | Map/Directions >>

Profile: Shanghai Record Pharmaceuticals Co., Ltd. produces pharmaceutical intermediates and fine chemical products. API & intermediates include aztreonam, (2S,3S)-3-amino-2-methyl-4-oxo-1-azetidinesulfonic acid , N-carbonyl-benzyloxy-L-threoninamide, N-phenylmethoxycarbonyl-3-aminopropanal, trilostane and zofenopril calcium salt. Organic silicone includes 1,3-bis(chloromethyl)-1,1,3,3-tetramethyldisiloxane, chloro(chloromethyl)dimethylsilane, allytrimethylsilane, 1,2-bis-trimethylsilanyl-ethyne, 1-(trimethylsilyl)propyne and allytrimethylsilane.

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• 4'-tert-Butylacetophenone
IUPAC Name: 1-(4-tert-butylphenyl)ethanone | CAS Registry Number: 943-27-1
Synonyms: p-tert-Butylacetophenone, 4-tert-Butylacetophenone, Acetophenone, 4'-tert-butyl-, 4-(tert-butyl)acetophenone, 357642_ALDRICH, NSC826, 1-(4-tert-Butylphenyl)ethanone, NSC 826, ALBB-002896, EINECS 213-399-3, ZINC01587617, Acetophenone, 4'-tert-butyl- (8CI), Ethanone, 1-[4-(1,1-dimethylethyl)phenyl]-, 1-((1,1-Dimethylethyl)phenyl)ethanone, Ethanone, 1-((1,1-dimethylethyl)phenyl)-, ST5405263, TL8005957, Ethanone, 1-(4-(1,1-dimethylethyl)phenyl)-, 1-(4-(1,1-DIMETHYLETHYL)PHENYL)ETHANONE, 43133-94-4

Molecular Formula: C12H16OMolecular Weight: 176.254840 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: UYFJYGWNYQCHOB-UHFFFAOYSA-N

• 5-Amino-2-bromobenzotrifluoride
IUPAC Name: 4-bromo-3-(trifluoromethyl)aniline | CAS Registry Number: 393-36-2
Synonyms: NCIOpen2_005308, 297712_ALDRICH, 4-Bromo-3-(trifluoromethyl)aniline, NSC88332, EINECS 206-885-1, ZINC00056672, 4-Bromo-3-trifluoromethyl-phenylamine, Benzenamine, 4-bromo-3-(trifluoromethyl)-, FS000998, ST5307033, TL8002839, 4-Bromo-alpha,alpha,alpha-trifluoro-m-toluidine

Molecular Formula: C7H5BrF3NMolecular Weight: 240.020510 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: YGNISOAUPSJDJE-UHFFFAOYSA-N

• 2-Bromo-4-Fluoroaniline
IUPAC Name: 2-bromo-4-fluoroaniline | CAS Registry Number: 1003-98-1
Synonyms: 2-Bromo-4-fluoroaniline, 2-Bromo-4-fluorobenzenamine, 369055_ALDRICH, NSC51870, CID242873, ZINC00159787, ST5408548, TL8000048

Molecular Formula: C6H5BrFNMolecular Weight: 190.013003 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: YLMFXCIATJJKQL-UHFFFAOYSA-N

• 3,4,5-Trifluorobenzaldehyde
IUPAC Name: 3,4,5-trifluorobenzaldehyde | CAS Registry Number: 132123-54-7
Synonyms: 3,4,5-Trifluoro-benzaldehyde, 529176_ALDRICH, ZINC02575049, JRD-0610, CID2776954

Molecular Formula: C7H3F3OMolecular Weight: 160.093330 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: NLAVHUUABUFSIG-UHFFFAOYSA-N

• 2,4,5-Trifluoro-3-bromobenzoic acid (CAS: 104222-46-6)
• 4-Cyano-3,5-difluorophenol
IUPAC Name: 2,6-difluoro-4-hydroxybenzonitrile | CAS Registry Number: 123843-57-2
Synonyms: 2,6-Difluoro-4-hydroxybenzonitrile, 4-hydroxy-2,6-difluorobenzonitrile, 3,5-difluoro-4-cyanophenol, 2,6-Difluoro-4-hydroxy benzonitrile, Benzonitrile, 2,6-difluoro-4-hydroxy-, 2,6-difluoro-4-hydroxybenzenecarbonitrile, SBB063847, AG-D-51079, ZINC02243358, PubChem5196, SureCN81244, ACMC-1BZ2H, AC1MCU11, 3.5-Difluoro-4-cyanophenol, KSC495C8F, Jsp001591, CTK3J5182, MolPort-000-150-717, ACT12409, 2,6-difluoro-4-hydroxy-benzonitrile

Molecular Formula: C7H3F2NOMolecular Weight: 155.101626 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: KEIYYIGMDPTAPL-UHFFFAOYSA-N

• 1-Chloro-6,6-dimethyl-2-heptene-4-yne
IUPAC Name: (E)-1-chloro-6,6-dimethylhept-2-en-4-yne | CAS Registry Number: 126764-17-8
Synonyms: 1-Chloro-6,6-dimethyl-5-hept-2-en-4-ino, SBB067016, 1-chloro-6,6-dimethyl-2-hepten-4-yne, (2E)-1-chloro-6,6-dimethylhept-2-en-4-yne, 2-Hepten-4-yne, 1-chloro-6,6-dimethyl-, MolPort-001-770-099, AM715, 287471-30-1, ACT05305, ZINC02525704, AKOS006222561, RP22074, 1-chloro-6,6-dimethylhept-2-en-4-yne, AK-33055, H583, KB-11948, E-1-Chloro-6,6-Dimethyl-2-hepten-4-yne, FT-0643056, FT-0652223, FT-0653560

Molecular Formula: C9H13ClMolecular Weight: 156.652520 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ZIXABMZBMHDFEZ-GQCTYLIASA-N

• 2-(2-Nitro-ethyl)-[1,3]dioxolane
IUPAC Name: 2-(2-nitroethyl)-1,3-dioxolane | CAS Registry Number: 82891-99-4
Synonyms: 2-(2-nitroethyl)-1,3-dioxolane, 2-(2-Nitroethyl)[1,3]dioxolane, 2-(2-Nitroethyl)-[1,3]dioxolane, 2-(2-nitro-ethyl)-[1,3]dioxolane, PubChem13716, PubChem16803, SureCN1476006, CTK5F0186, MolPort-001-758-106, 1,3-Dioxolane,2-(2-nitroethyl)-, ANW-49894, ZINC15021206, AKOS006227597, AG-H-31512, RP21120, AK-36488, BR-36488, KB-162490, 3-Nitropropionaldehyde ethylene glycol acetal, FT-0641887

Molecular Formula: C5H9NO4Molecular Weight: 147.129260 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: ZYXOSRQIZOOVTN-UHFFFAOYSA-N

• 2,3,4-Trimethoxy-6-methylphenol
IUPAC Name: 2,3,4-trimethoxy-6-methylphenol | CAS Registry Number: 39068-88-7
Synonyms: PubChem3208, Jsp006798, CTK4I0878, MolPort-001-758-028, 2-Hydroxy-3,4,5-trimethoxytoluene, ZINC15021201, Phenol,2,3,4-trimethoxy-6-methyl-, AKOS006344548, AC-1426, AG-F-37925, AK-34976, KB-16546, FT-0082683, FT-0639520, FT-0652359, ST51051819, M-2278, I01-5767, 2,3,4-Trimethoxy-6-methylphenol;2-Methyl-4,5,6-trimethoxyphenol;4,5,6-Trimethoxy-2-methylphenol;6-Methyl-2,3,4-trimethoxyphenol;

Molecular Formula: C10H14O4Molecular Weight: 198.215760 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: UGNJWQMNCJYWHG-UHFFFAOYSA-N

• 3,4-Dimethoxy-3-cyclobutene-1,2-dione
IUPAC Name: 3,4-dimethoxycyclobut-3-ene-1,2-dione | CAS Registry Number: 5222-73-1
Synonyms: Dimethyl squarate, Squaric acid dimethyl ester, 377406_ALDRICH, ZINC02145277, 3-Cyclobutene-1,2-dione,3,4-dimethoxy-, 3-Cyclobutene-1,2-dione, 3,4-dimethoxy-, TL8003447

Molecular Formula: C6H6O4Molecular Weight: 142.109440 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: SZBNZTGCAMLMJY-UHFFFAOYSA-N

• 5-Amino-2-fluorobenzonitrile
IUPAC Name: 5-amino-2-fluorobenzonitrile | CAS Registry Number: 53312-81-5
Synonyms: 3-Cyano-4-fluoroaniline, 2-fluoro-5-aminobenzonitrile, SBB064176, ZINC02565103, 3-cyano-4-fluoro aniline, 3-Cyano-4-fluoroaniline;, SureCN145984, AC1MC7O1, AC1Q51KZ, 3-amino-6-fluorobenzonitrile, KSC494A6L, 5-amino-2-fluoro benzonitrile, 5-Amino-2-fluoro-benzonitrile, 639877_ALDRICH, AC1Q521D, 3-CYANO-4-FLUOROANILIN, CTK3J4065, MolPort-000-151-066, 5-amino-2-fluorobenzenecarbonitrile, ACN-S003814

Molecular Formula: C7H5FN2Molecular Weight: 136.126403 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: HHTRAISBAAXRKZ-UHFFFAOYSA-N

• 2,2,2-Trifluoro-3',5'-Difluoroacetophenone
IUPAC Name: 1-(3,5-difluorophenyl)-2,2,2-trifluoroethanone | CAS Registry Number: 845823-12-3
Synonyms: 1-(3,5-difluorophenyl)-2,2,2-trifluoroethanone, 2,2,2,3',5'-Pentafluoroacetophenone, 2,2,2-trifluoro-3',5'-difluoroacetophenone, ST51042125, 1-(3,5-difluorophenyl)-2,2,2-trifluoroethan-1-one, 1-(3,5-Difluoro-phenyl)-2,2,2-trifluoro ethanone, 1-[3,5-bis(fluoranyl)phenyl]-2,2,2-tris(fluoranyl)ethanone, ZINC02378572, PubChem13687, AC1MC2CF, SureCN3644955, CTK8B4235, MolPort-000-157-933, ANW-44425, CL8646, SBB094292, 2,2,2,3'5'-pentafluoroacetophenone, AKOS012259167, 1,1,1,3',5'-pentafluoroacetophenone, AB08943

Molecular Formula: C8H3F5OMolecular Weight: 210.100836 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 6

InChIKey: VPJBBHOADBTNFQ-UHFFFAOYSA-N

• 3-Bromo-4,5,6-Trimethoxy-2-Methylphenol
IUPAC Name: 5-bromo-2,3,4-trimethoxy-6-methylphenol | CAS Registry Number: 918799-14-1
Synonyms: 3-Bromo-4,5,6-trimethoxy-2-methylphenol, 3-Bromo-4,5,6-trimethoxy-2-methyl-phenol, PubChem13664, ZINC38339148, AKOS015890513, AC-4355, AK-36874, 5-bromo-2,3,4-trimethoxy-6-methylphenol, KB-181116, FT-0646725, ST51052075, 5-bromanyl-2,3,4-trimethoxy-6-methyl-phenol, A844089, I01-6422

Molecular Formula: C10H13BrO4Molecular Weight: 277.111820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: UPFOLLAZMUMUCI-UHFFFAOYSA-N

• 2,6-Difluoroaniline
IUPAC Name: 2,6-difluoroaniline | CAS Registry Number: 5509-65-9
Synonyms: Benzenamine, 2,6-difluoro-, 196614_ALDRICH, BB_SC-4594, EINECS 226-853-0, NSC127234, ZINC00159273, D155, TL8003601, InChI=1/C6H5F2N/c7-4-2-1-3-5(8)6(4)9/h1-3H,9H

Molecular Formula: C6H5F2NMolecular Weight: 129.107406 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: ODUZJBKKYBQIBX-UHFFFAOYSA-N

• 4-Bromo-2-Fluoroaniline
IUPAC Name: 4-bromo-2-fluoroaniline | CAS Registry Number: 367-24-8
Synonyms: 4-Bromo-2-fluoroaniline, Benzenamine, 4-bromo-2-fluoro-, nchembio.2007.34-comp12, 304220_ALDRICH, ZINC00152960, EINECS 206-685-4, CID123050, B126, TL806376, ST5213767

Molecular Formula: C6H5BrFNMolecular Weight: 190.013003 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: GZRMNMGWNKSANY-UHFFFAOYSA-N

• 2,4,6-Trifluorobenzoic acid
IUPAC Name: 2,4,6-trifluorobenzoic acid | CAS Registry Number: 28314-80-9
Synonyms: 345784_ALDRICH, JRD-0084, CID520373, SBB006688, TL806137, InChI=1/C7H3F3O2/c8-3-1-4(9)6(7(11)12)5(10)2-3/h1-2H,(H,11,12

Molecular Formula: C7H3F3O2Molecular Weight: 176.092730 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: SJZATRRXUILGHH-UHFFFAOYSA-N

• (R)-(+)-4-Methyl-1,3-dioxolan-2-one
IUPAC Name: (4R)-4-methyl-1,3-dioxolan-2-one | CAS Registry Number: 16606-55-6
Synonyms: (R)-(+)-Propylene carbonate, (R)-4-Methyl-1,3-dioxolan-2-one, (R)-PropyleneCarbonate, (R)-1,2-PROPYLENE CARBONATE, (R)-1,2-Propanediol cyclic carbonate, (4R)-4-methyl-1,3-dioxolan-2-one, PubChem6059, (R)-Propylene Carbonate, AC1LD3MQ, SureCN748245, KSC493I9J, 540013_ALDRICH, Jsp003338, CTK3J3494, MolPort-001-758-105, ANW-22184, ZINC02041090, (R)-(+)-1,2-Propylene Carbonate, AKOS015840866, AKOS015900872

Molecular Formula: C4H6O3Molecular Weight: 102.088640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: RUOJZAUFBMNUDX-GSVOUGTGSA-N

• 1-Benzhydryl Azetidine-3-ol hydrochloride
IUPAC Name: 1-[di(phenyl)methyl]azetidin-3-ol | CAS Registry Number: 18621-17-5
Synonyms: Maybridge1_002189, Maybridge3_003982, 1-Benzhydrylazetidin-3-ol, 1-Benzhydryl-azetidin-3-ol, Oprea1_406945, CBDivE_000245, CBDivE_013047, NSC319045, BB_SC-3386, ALBB-010097, 3-Azetidinol, 1-(diphenylmethyl)-, CID330448, IDI1_015369, TL8001505, 1-(diphenylmethyl)azetidin-3-ol hydrochloride, SR-01000639368-1, 90604-02-7

Molecular Formula: C16H17NOMolecular Weight: 239.312280 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: MMAJXKGUZYDTHV-UHFFFAOYSA-N

• 2,4,5-Trifluorophenylacetic acid
IUPAC Name: 2-(2,4,5-trifluorophenyl)acetic acid | CAS Registry Number: 209995-38-0
Synonyms: 684155_ALDRICH, JRD-0716, TL8001736

Molecular Formula: C8H5F3O2Molecular Weight: 190.119310 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: YSQLGGQUQDTBSL-UHFFFAOYSA-N

• 4-(Trifluoromethyl)phenylacetonitrile
IUPAC Name: 2-[4-(trifluoromethyl)phenyl]acetonitrile | CAS Registry Number: 2338-75-2
Synonyms: p-Trifluoromethylphenylacetonitrile, 232963_ALDRICH, JRD-0268, EINECS 219-052-2, SBB006690, ZINC01841309

Molecular Formula: C9H6F3NMolecular Weight: 185.145850 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: QNKOCFJZJWOXDE-UHFFFAOYSA-N

• 4-Bromo-3-(trifluoromethyl)phenol
IUPAC Name: 4-bromo-3-(trifluoromethyl)phenol | CAS Registry Number: 320-49-0
Synonyms: 4-bromo-3-(trifluoromethyl)phenol, 3-Trifluoromethyl-4-bromophenol, 2-bromo-5-hydroxybenzotrifluoride, 4-Bromo-3-trifluromethylphenol, 4-Bromo-3-trifluoromethylphenol, AG-F-06976, PubChem2111, ACMC-1AHMZ, SureCN177740, Jsp005943, CTK3J4864, 3-trifluoromethyl-4-bromo phenol, 4-bromo-3-trifluoromethyl phenol, 4-bromo-3-trifluoromethyl-phenol, MolPort-001-775-255, ACN-S003582, ACT00233, ANW-27251, FC1194, SBB099360

Molecular Formula: C7H4BrF3OMolecular Weight: 241.005270 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 4

InChIKey: VOWPIDJSINRFPZ-UHFFFAOYSA-N

• 3-[(Benzyloxycarbonyl)amino]-1-propanal
IUPAC Name: benzyl N-(3-oxopropyl)carbamate | CAS Registry Number: 65564-05-8
Synonyms: Benzyl 3-oxopropylcarbamate, 3-[(Benzyloxycarbonyl)amino]propionaldehyde, SBB063067, Benzyl N-(3-oxopropyl)carbamate, PubChem13633, ACMC-1B9J1, Benzyl (3-oxopropyl)carbamate, 592951_ALDRICH, CTK8B8189, MolPort-001-758-081, ANW-59603, ZINC02548286, AKOS015888131, AC-4333, AG-G-46877, N-Phenylmethoxycarbonyl-3-aminopropanal, 3-[(Carbobenzyloxy)amino]propionaldehyde, AK-45796, KB-29122, N-(3-oxopropyl)(phenylmethoxy)carboxamide

Molecular Formula: C11H13NO3Molecular Weight: 207.225820 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: PQMOZOQTXKMYSK-UHFFFAOYSA-N

• 4-(3-Trifluoromethylphenyl)piperidine hydrochloride
IUPAC Name: 4-[3-(trifluoromethyl)phenyl]piperidine;hydrochloride | CAS Registry Number: 6652-16-0
Synonyms: 4-(3-Trifluoromethylphenyl)Piperidine Hydrochloride, CHEMBL2011553, 4-[3-(trifluoromethyl)phenyl]piperidine hydrochloride, 3-Trifluoromethylphenylpiperidine hydrochloride, 4-(3-TRIFLUOROMETHYLPHENYL)PIPERIDINE HCL, 4-(3-Trifluoromethylphenyl)piperidine Hydrochloric Salt, 4-(3-Trifluoromethyl-phenyl)-piperidine 1HCl salt, PubChem1922, SureCN2273758, CTK7B6801, MolPort-001-777-447, ANW-54697, RW1116, SBB102962, AKOS015849846, AB10970, AC-4341, AG-A-66790, AG-G-51046, AK-36048

Molecular Formula: C12H15ClF3NMolecular Weight: 265.702410 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: OGZONGZRKSIERU-UHFFFAOYSA-N

• 2-Chloro-6-(trifluoromethyl)nicotinic acid
IUPAC Name: 2-chloro-6-(trifluoromethyl)pyridine-3-carboxylic acid | CAS Registry Number: 280566-45-2
Synonyms: 2-Chloro-6-trifluoromethylnicotinic acid, 2-chloro-6-(trifluoromethyl)pyridine-3-carboxylic Acid, SBB053025, AG-E-89703, 2-chloro-6-trifluoromethylpyridine-3-carboxylic acid, 2-Chloro-6-(trifluoromethyl)-3-pyridinecarboxylic Acid, PubChem13677, AC1MCSS5, ACMC-1C67O, Jsp005409, CTK1A1832, MolPort-000-002-892, ACT06721, ANW-26326, WT2144, AKOS005063886, AB10268, RP18006, 2-chloro-6-trifluoromethyl nicotinic acid, 2-chloro-6-trifluoromethyl-nicotinic acid

Molecular Formula: C7H3ClF3NO2Molecular Weight: 225.552430 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: DXRBTBMFFGEVCX-UHFFFAOYSA-N

• 2-fluoro-N-methylaniline
IUPAC Name: 2-fluoro-N-methylaniline | CAS Registry Number: 1978-38-7
Synonyms: 2-Fluoro-N-methylaniline, n-methyl-2-fluoroaniline, SBB051706, AG-E-44518, ZINC02243024, AC1MBZFP, PubChem15527, ACMC-1BU0L, SureCN307353, AC1Q40W3, CTK3J7443, MolPort-000-155-670, n-(2-fluorophenyl)-n-methylamine, ACT00165, ANW-23785, AKOS000259941, LS10646, MCULE-7682744579, AC-13791, AK-48931

Molecular Formula: C7H8FNMolecular Weight: 125.143523 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: LDVAIJZDACHGML-UHFFFAOYSA-N

• 1,7-Dichloro-4-Oxo-Heptane
IUPAC Name: 1,7-dichloroheptan-4-one | CAS Registry Number: 40624-07-5
Synonyms: 1,7-Dichloro-4-heptanone, 4-Heptanone, 1,7-dichloro-, NSC60201, CID246749

Molecular Formula: C7H12Cl2OMolecular Weight: 183.075580 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: SCKUIKDAPAUGBE-UHFFFAOYSA-N

• 2-Bromo-1-Fluoronaphthalene
IUPAC Name: 2-bromo-1-fluoronaphthalene | CAS Registry Number: 317-79-3
Synonyms: 2-BROMO-1-FLUORONAPHTHALENE, 2-Bromo-1-fluoro-naphthalene, AG-F-06032, PubChem13696, SureCN1248560, Naphthalene,2-bromo-1-fluoro-, Jsp005908, CTK4G7714, MolPort-001-777-475, 2-bromanyl-1-fluoranyl-naphthalene, PC8694, SBB096774, AC-2362, RP05353, AK140096, KB-84684, FT-0646119, Y8692, A820985

Molecular Formula: C10H6BrFMolecular Weight: 225.057043 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: WPNSUUQOEPQDOI-UHFFFAOYSA-N

• 2-Bromo-3,4,5,6-tetramethoxytoluene
IUPAC Name: 1-bromo-2,3,4,5-tetramethoxy-6-methylbenzene | CAS Registry Number: 73875-27-1
Synonyms: 2-Methyl-3,4,5,6-tetramethoxybromobenzene, 1-Bromo-2,3,4,5-tetramethoxy-6-methylbenzene, 2-bromo-3,4,5,6-tetramethoxytoluene, AG-G-92861, PubChem13663, CTK5D8847, MolPort-001-758-026, ZINC15021199, AKOS015890011, AC-4354, AG-G-87368, AK-36254, P424, KB-173641, TL8005110, FT-0641492, FT-0658053, ST51051843, A837948, Benzene,1-bromo-2,3,4,5-tetramethoxy-6-methyl-

Molecular Formula: C11H15BrO4Molecular Weight: 291.138400 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: FQPOTLCIUAYGPN-UHFFFAOYSA-N

• 2-(Trifluoromethyl)benzenesulfonamide
IUPAC Name: 2-(trifluoromethyl)benzenesulfonamide | CAS Registry Number: 1869-24-5
Synonyms: 2-trifluoromethylbenzenesulfonamide, 2-(trifluoromethyl) benzenesulfonamide, AG-E-36069, 2-(trifluoromethyl)benzene-1-sulfonamide, ST50408488, ZINC02584327, AC1MCSCT, PubChem11781, ACMC-20a48s, SureCN302570, KSC174G3H, 563552_ALDRICH, CTK0H4333, o-trifluoromethylbenzenesulfonamide, MolPort-000-150-718, 2-trifluoromethylbenzenesul fonamide, ACN-S002595, ANW-56426, SBB096801, 2-(trifluoromethyl)benzenesulphonamide

Molecular Formula: C7H6F3NO2SMolecular Weight: 225.188250 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 6

InChIKey: AFFPZJFLSDVZBV-UHFFFAOYSA-N

• 2-Amino-4-Methyl Pyridine
IUPAC Name: 4-methylpyridin-2-amine | CAS Registry Number: 695-34-1
Synonyms: Ascensil, 2-Amino-4-picoline, 4-Picolylamine, Aminton, W 45 Raschig, 2-amino-4-methylpyridine, 4-Methyl-2-pyridinamine, 2-Pyridinamine, 4-methyl-, 4-Methyl-2-pyridylamine, 4-Methyl-2-aminopyridine, 4-PICOLINE, 2-AMINO-, Methyl-4 amino-2-pyridine, nchembio.115-comp6, 4M2AP, alpha-Amino-gamma-picoline, Tocris-1020, Pyridine, 2-amino-4-methyl-, 4-methylpyridin-2-ylamine, WLN: T6NJ BZ D1, 4-METHYLPYRIDIN-2-AMINE

Molecular Formula: C6H8N2Molecular Weight: 108.141120 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: ORLGLBZRQYOWNA-UHFFFAOYSA-N

• (R)-(+)-2-Methyl-2-propanesulfinamide
IUPAC Name: 2-methylpropane-2-sulfinamide | CAS Registry Number: 196929-78-9
Synonyms: (R)-(+)-t-Butylsulfinamide, (R)-(+)-tert-Butylsulfinamide, (r)-(+)-tert-butyl sulphinamide, (r)-2-methyl-2-propanesulfinamide, SBB056498, (r)-(+)-2-methyl-propane-2-sulfinic acid amide, (r)-2-methylpropane-2-sulfinamide, (R)-tert-Butanesulfinamide, PubChem6058, r-tert-butanesulfinamide, r-(+)tert-butansulfinamide, r-(+)-tert-butylsulfinamide, KSC174O3L, (r)-(+)-t-butanesulfinamide, (r)-(+)tert-butanesulfinamide, 497401_ALDRICH, (r)-(+)-tert-butanesulfinamide, CTK0H4735, (R)-(+)-tert-Butyl sulfinamide, MolPort-002-461-779

Molecular Formula: C4H11NOSMolecular Weight: 121.201240 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 3

InChIKey: CESUXLKAADQNTB-SSDOTTSWSA-N

• 4-Fluoro-3-(trifluoromethyl)phenol
IUPAC Name: 4-fluoro-3-(trifluoromethyl)phenol | CAS Registry Number: 61721-07-1
Synonyms: ZINC00164785, 2-Fluoro-5-hydroxybenzotrifluoride, JRD-0275, CID601854, SB 01726

Molecular Formula: C7H4F4OMolecular Weight: 180.099673 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: DHPCRFYUUWAGAH-UHFFFAOYSA-N

• 2-[(2-Aminothiazol-4-yl)carboxymethyleneaminooxy]-2-methylpropionic acid
IUPAC Name: 2-[[(2-amino-1,3-thiazol-4-yl)-carboxymethylidene]amino]oxy-2-methylpropanoic acid | CAS Registry Number: 80542-76-3
Synonyms: AG-H-23875, AGN-PC-01Z4ZI, CTK5E7889, (Z)-2-((((2-Aminothiazol-4-yl)(carboxy)methylene)amino)oxy)-2-methylpropanoic acid, 102507-85-7, ANW-72102, KB-166304, A839938, 2-[(E)-[(2-amino-1,3-thiazol-4-yl)-carboxymethylidene]amino]oxy-2-methylpropanoic acid, 2-[[(2-amino-4-thiazolyl)-carboxymethylidene]amino]oxy-2-methylpropanoic acid, 2-[[1-(2-azanyl-1,3-thiazol-4-yl)-2-oxidanyl-2-oxidanylidene-ethylidene]amino]oxy-2-methyl-propanoic acid, 4-Thiazoleacetic acid,2-amino-a-[[2-(diphenylmethoxy)-1,1-dimethyl-2-oxoethoxy]imino]-,(Z)- (9CI)

Molecular Formula: C9H11N3O5SMolecular Weight: 273.265740 [g/mol]
H-Bond Donor: 3H-Bond Acceptor: 9

InChIKey: VNCBMEHASYISTH-UHFFFAOYSA-N

• (Bromomethyl)Trimethylsilane
IUPAC Name: bromomethyl(trimethyl)silane | CAS Registry Number: 18243-41-9
Synonyms: (Bromomethyl)trimethylsilane, Silane, (bromomethyl)trimethyl-, (Trimethylsilyl)methyl bromide, 249777_ALDRICH, CID87523

Molecular Formula: C4H11BrSiMolecular Weight: 167.119640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: ACAUYCZBWABOLI-UHFFFAOYSA-N

• 3,5-Dichloro Benzonitrile
IUPAC Name: 3,5-dichlorobenzonitrile | CAS Registry Number: 6575-00-4
Synonyms: 3,5-Dichlorobenzonitrile, Benzonitrile, 3,5-dichloro-, 139394_ALDRICH, EINECS 229-495-3, NSC109596, ZINC00159427, AI3-34463, ST5308522, TL8004663, InChI=1/C7H3Cl2N/c8-6-1-5(4-10)2-7(9)3-6/h1-3

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

InChIKey: PUJSUOGJGIECFQ-UHFFFAOYSA-N

• 4-Fluorophenol
IUPAC Name: 4-fluorophenol | CAS Registry Number: 371-41-5
Synonyms: 4-FLUOROPHENOL, Phenol, p-fluoro-, p-Fluorophenol, Phenol, 4-fluoro-, CCRIS 665, F13207_ALDRICH, EINECS 206-736-0, NSC 10295, NSC10295, BRN 1362752, ZINC00164463, TL806436, LS-104664, ST5214377, C16485, 4-06-00-00773 (Beilstein Handbook Reference), FPN

Molecular Formula: C6H5FOMolecular Weight: 112.101703 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 2

InChIKey: RHMPLDJJXGPMEX-UHFFFAOYSA-N

• 2-Bromo Biphenyl
IUPAC Name: 1-bromo-2-phenylbenzene | CAS Registry Number: 2052-07-5
Synonyms: 2-Bromobiphenyl, Biphenyl, 2-bromo-, O-BROMOBIPHENYL, 1,1'-Biphenyl, 2-bromo-, 2-Bromo-1,1'-biphenyl, CCRIS 5888, NCIOpen2_003445, MLS002152871, 252247_ALDRICH, NSC67353, EINECS 218-141-3, NSC 67353, CID16329, LS-992, AI3-11170, OR13698, NCGC00091586-01, SMR001224489, I01-0812, InChI=1/C12H9Br/c13-12-9-5-4-8-11(12)10-6-2-1-3-7-10/h1-9

Molecular Formula: C12H9BrMolecular Weight: 233.103860 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 0

InChIKey: KTADSLDAUJLZGL-UHFFFAOYSA-N

• 3-Cyclopentylacrylonitrile
IUPAC Name: (E)-3-cyclopentylprop-2-enenitrile | CAS Registry Number: 591769-05-0
Synonyms: SureCN99596, AC1Q4Q6F, (E)-3-cyclopentylacrylonitrile, (2E)-3-cyclopentylprop-2-enenitrile, AKOS011598462, I14-27377

Molecular Formula: C8H11NMolecular Weight: 121.179640 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: VMELXYJYSXXORF-ZZXKWVIFSA-N

• 2-Chloro-6-(trifluoromethyl)nicotinonitrile
IUPAC Name: 4-(8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridin-7-yl)-4-oxobutanoic acid | CAS Registry Number: 389117-37-7
Synonyms: 4-(8,9-dihydropyrido[2,3-b]-1,6-naphthydrin-7(6h)-yl)-4-oxobutanoic acid, 4-(8,9-Dihydropyrido[2,3-b]-1,6-naphthyridin-7(6H)-yl)-4-oxobutanoic acid, Peakdale1_000272, PubChem4804, AC1MC47H, Ambpe3000160, CTK7J2738, HMS518M08, MolPort-000-159-669, AKOS015854472, AG-A-68290, KB-85222, FT-0658772, 4-(7,8-Dihydro-5H-1,6,9-triazaanthracen-6-yl)-4-oxobutanoic acid, 4-(7,8-Dihydro-5H-1,6,9-triazaanthracen-6-yl)-4-oxobutyric acid, 4-oxo-4-{6H,8H,9H-pyrido[2,3-b]1,6-naphthyridin-7-yl}butanoic acid, 7-(3-Carboxypropanoyl)-6,7,8,9-tetrahydropyrido[2,3-b][1,6]naphthyridine, 4-(8,9-dihydro-6H-pyrido[4,3-b][1,8]naphthyridin-7-yl)-4-oxobutanoic acid, 4-(8,9-Dihydropyrido[2,3-b][1,6]naphthydrin-7(6H)-yl)-4-oxobutanoic acid

Molecular Formula: C15H15N3O3Molecular Weight: 285.297900 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: RBEDQSQRUFHMKD-UHFFFAOYSA-N

• 1,2,3-Triazole-4-Carboxylic Acid
IUPAC Name: 2H-triazole-4-carboxylic acid | CAS Registry Number: 16681-70-2
Synonyms: Triazole, TRZ10, 5-Carboxy-1,2,3-triazole, 4-Carboxy-1,2,3-triazole, NSC77700, 1H-1,2,3-Triazole-5-carboxylic acid, MolPort-001-916-090, 1,2,3-triazole-4-carboxylic acid, CID140120, 1H-1,2,3-triazole-4-carboxylic acid, BBV-27019317, TL8001283, TL8007108, T0501-8693

Molecular Formula: C3H3N3O2Molecular Weight: 113.074820 [g/mol]
H-Bond Donor: 2H-Bond Acceptor: 4

InChIKey: GTODOEDLCNTSLG-UHFFFAOYSA-N

• 2,4,5-Trifluorobenzoic Acid
IUPAC Name: 2,4,5-trifluorobenzoate | CAS Registry Number: 446-17-3
Synonyms: ZINC00164626, CID6933310

Molecular Formula: C7H2F3O2-Molecular Weight: 175.084790 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: AKAMNXFLKYKFOJ-UHFFFAOYSA-M

• 2,6-Difluoro Pyridine
IUPAC Name: 2,6-difluoropyridine | CAS Registry Number: 1513-65-1
Synonyms: 2,6-DIFLUOROPYRIDINE, Pyridine, 2,6-difluoro-, Ambap3086, 2,6-Difluoro-pyridine, CCRIS 1720, TPC-PY089, 233277_ALDRICH, EINECS 216-152-8, NSC331814, NSC 331814, CID73934, ZINC00388533, D230, TL806316, LS-188236

Molecular Formula: C5H3F2NMolecular Weight: 115.080826 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: MBTGBRYMJKYYOE-UHFFFAOYSA-N

• 3-Trifluoromethyl Benzoic Acid
IUPAC Name: 3-(trifluoromethyl)benzoic acid | CAS Registry Number: 454-92-2
Synonyms: 3-(Trifluoromethyl)benzoic acid, 3-Carboxybenzotrifluoride, 3-Trifluoromethylbenzoate, m-CARBOXYBENZOTRIFLUORIDE, 188344_ALDRICH, m-(Trifluoromethyl)benzoic acid, 91770_FLUKA, AIDS018130, alpha,alpha,alpha-Trifluoro-m-toluic acid, AIDS-018130, JRD-0051, NSC43025, 3-TRIFLUOROMETHYLBENZOIC ACID, Benzoic acid, 3-(trifluoromethyl)-, EINECS 207-230-2, NSC 43025, SBB003661, alpha,alpha,alpha-Tri-fluoro-m-toluic acid, Benzoic acid, 3-(trifluoromethyl)- (9CI), TL8003158

Molecular Formula: C8H5F3O2Molecular Weight: 190.119310 [g/mol]
H-Bond Donor: 1H-Bond Acceptor: 5

InChIKey: FQXQBFUUVCDIRK-UHFFFAOYSA-N

• 4-Bromo-3-(trifluoromethyl)benzonitrile
IUPAC Name: 4-bromo-3-(trifluoromethyl)benzonitrile | CAS Registry Number: 1735-53-1
Synonyms: 3-Trifluoromethyl-4-bromobenzonitrile, 2-Bromo-5-cyanobenzotrifluoride, 4-bromo-3-(trifluoromethyl)benzenecarbonitrile, SBB063633, AG-E-23097, PubChem1576, ACMC-209e6z, SureCN403023, KSC494O4T, Jsp003542, CTK3J4749, MolPort-001-771-684, WT108, ACT00890, ANW-22665, ZINC02384143, AKOS015853121, 3-Trifluoromethyl-4-bromo benzonitrile, AB13696, AC-1434

Molecular Formula: C8H3BrF3NMolecular Weight: 250.015330 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: KSXUIQQDHHFSRN-UHFFFAOYSA-N

• 2-(2,3-Epoxypropoxy)-3-phenylproplophenone
IUPAC Name: 1-[2-(oxiran-2-ylmethoxy)phenyl]-3-phenylpropan-1-one | CAS Registry Number: 22525-95-7
Synonyms: EINECS 245-052-7, CID90797, 2'-(Oxiranylmethoxy)-3-phenylpropiophenone

Molecular Formula: C18H18O3Molecular Weight: 282.333720 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 3

InChIKey: AUZMQKJKLUZHBY-UHFFFAOYSA-N

• 4-tert-Butylphenylacetonitrile
IUPAC Name: 2-(4-tert-butylphenyl)acetonitrile | CAS Registry Number: 3288-99-1
Synonyms: p-tert-Butylbenzylcyanide, p-tert-Butylbenzeneacetontrile, (4-tert-Butylphenyl)acetonitrile, Acetonitrile, (p-tert-butylphenyl)-, NSC85354, EINECS 221-944-1, NSC 85354, ZINC01760302, BBV-040633, Benzeneacetonitrile, 4-(1,1-dimethylethyl)-

Molecular Formula: C12H15NMolecular Weight: 173.254200 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 1

InChIKey: QKJPXROEIJPNHG-UHFFFAOYSA-N

• 2,3,4,5-Tetramethoxytoluene
IUPAC Name: 1,2,3,4-tetramethoxy-5-methylbenzene | CAS Registry Number: 35896-58-3
Synonyms: 2,3,4,5-tetramethoxytoluene, 1,2,3,4-tetramethoxy-5-methyl-benzene, 1,2,3,4-tetramethoxy-5-methylbenzene, CTK4H5541, MolPort-003-986-787, ACN-S002045, ACT00411, ANW-47085, ZINC14590475, AKOS015889821, AG-F-24781, AC-18429, AK-48185, BR-48185, Benzene,1,2,3,4-tetramethoxy-5-methyl-, KB-224931, TL8002661, FT-0639288, ST51051818, M-2070

Molecular Formula: C11H16O4Molecular Weight: 212.242340 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: OIWAVVSMXFIBCD-UHFFFAOYSA-N

• 6-Hydroxy-3,4-dihydro-1H-quinolin-2-one
IUPAC Name: 6-hydroxy-3,4-dihydro-1H-quinolin-2-one | CAS Registry Number: 54197-66-9
Synonyms: 6-hydroxy-3,4-dihydroquinolinone, ZINC03957998, CID2774040, TL8003558

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

InChIKey: HOSGXJWQVBHGLT-UHFFFAOYSA-N

• 2,3-Dimethoxy-5-methyl-1,4-benzoquinone
IUPAC Name: 2,3-dimethoxy-5-methylcyclohexa-2,5-diene-1,4-dione | CAS Registry Number: 605-94-7
Synonyms: Ubiquinone-0, Coenzyme Q0, Ubiquinone 0, Ubiquinone-O, Ubiquinone Q0, CoQ0, nchembio.62-comp10, Ccris 7153, D9150_SIGMA, 2-Methyl-4,5-dimethoxy-p-quinone, 2,3-Dimethoxy-5-methylbenzoquinone, STOCK1N-17426, 2,3-Dimethoxy-5-methyl-p-benzoquinone, CHEBI:27906, 2,3-Dimethoxy-5-methylbenzo-1,4-quinone, 2-Methyl-5,6-dimethoxybenzoquinone, CID69068, EINECS 210-100-8, CPD0-1464, p-Benzoquinone, 2,3-dimethoxy-5-methyl-

Molecular Formula: C9H10O4Molecular Weight: 182.173300 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 4

InChIKey: UIXPTCZPFCVOQF-UHFFFAOYSA-N

• 2,4,5-Trifluoro-3-chlorobenzoic acid
IUPAC Name: 3-chloro-2,4,5-trifluorobenzoate | CAS Registry Number: 101513-77-3
Synonyms: ZINC02526219, CID7016347

Molecular Formula: C7HClF3O2-Molecular Weight: 209.529850 [g/mol]
H-Bond Donor: 0H-Bond Acceptor: 5

InChIKey: KBESHLYCSZINAJ-UHFFFAOYSA-M


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