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Polychlorinated biphenyls
Description:
Organic compounds containing at least two chlorine atoms attached to either benzene ring of the biphenyl moiety.
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2,2',4,4',5-PentachlorobiphenylCas Number: 38380-01-7Formula: C12H5Cl5 Molecular Weight: 326.4331IUPAC Name: 1,2,4-trichloro-5-(2,4-dichlorophenyl)benzeneSMILES: C1=CC(=C(C=C1Cl)Cl)C2=CC(=C(C=C2Cl)Cl)ClInChIKey: LMQJBFRGXHMNOX-UHFFFAOYSA-NInChI: InChI=1S/C12H5Cl5/c13-6-1-2-7(9(14)3-6)8-4-11(16)12(17)5-10(8)15/h1-5H -
2,2',3,4,4',5,5'-HeptachlorobiphenylCas Number: 35065-29-3 EC Number: 208-759-1Formula: C12H3Cl7 Molecular Weight: 395.32IUPAC Name: 1,2,3,4-tetrachloro-5-(2,4,5-trichlorophenyl)benzeneSMILES: C1=C(C(=CC(=C1Cl)Cl)Cl)C2=CC(=C(C(=C2Cl)Cl)Cl)ClInChIKey: WBHQEUPUMONIKF-UHFFFAOYSA-NInChI: InChI=1S/C12H3Cl7/c13-6-3-8(15)7(14)1-4(6)5-2-9(16)11(18)12(19)10(5)17/h1-3HSynonyms: 2,2',3,4,4',5,5'-PCB | PCB 180
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2,2',3,4,5,6'-HexachlorobiphenylCas Number: 68194-15-0Formula: C12H4Cl6 Molecular Weight: 360.88IUPAC Name: 1,2,3,4-tetrachloro-5-(2,6-dichlorophenyl)benzeneSMILES: C1=CC(=C(C(=C1)Cl)C2=CC(=C(C(=C2Cl)Cl)Cl)Cl)ClInChIKey: UQPQKLGBEKEZBV-UHFFFAOYSA-NInChI: InChI=1S/C12H4Cl6/c13-6-2-1-3-7(14)9(6)5-4-8(15)11(17)12(18)10(5)16/h1-4HSynonyms: PCB NO 143 | BZNO 143 | PCB 143 | 223456HEXACHLOROBIPHENYL(2,2',3,4,5,6'-HEXACHLOROISOMERICFORM) | 1,1'-BIPHENYL,2,2'...
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2-(3，4-Dichlorophenyl)-4-fluoroanilineCas Number: 877179-04-9 Compound CID: 11572419Formula: C12H8Cl2FN Molecular Weight: 256.11IUPAC Name: 2-(3,4-dichlorophenyl)-4-fluoroanilineSMILES: C1=CC(=C(C=C1C2=C(C=CC(=C2)F)N)Cl)ClInChIKey: QUVGVAKQHNJQNN-UHFFFAOYSA-NInChI: InChI=1S/C12H8Cl2FN/c13-10-3-1-7(5-11(10)14)9-6-8(15)2-4-12(9)16/h1-6H,16H2
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NiclofolanIUPAC Name: 4-chloro-2-(5-chloro-2-hydroxy-3-nitrophenyl)-6-nitrophenolSMILES: C1=C(C=C(C(=C1C2=C(C(=CC(=C2)Cl)[N+](=O)[O-])O)O)[N+](=O)[O-])ClInChIKey: XULACPAEUUWKFX-UHFFFAOYSA-NInChI: InChI=1S/C12H6Cl2N2O6/c13-5-1-7(11(17)9(3-5)15(19)20)8-2-6(14)4-10(12(8)18)16(21)22/h1-4,17-18H
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3'，5'-Dichloro-[1，1'-biphenyl]-4-carboxylic acidCas Number: 190911-79-6 Compound CID: 2758080Formula: C13H8Cl2O2 Molecular Weight: 267.11IUPAC Name: 4-(3,5-dichlorophenyl)benzoic acidSMILES: C1=CC(=CC=C1C2=CC(=CC(=C2)Cl)Cl)C(=O)OInChIKey: IFTKERBYCONAST-UHFFFAOYSA-NInChI: InChI=1S/C13H8Cl2O2/c14-11-5-10(6-12(15)7-11)8-1-3-9(4-2-8)13(16)17/h1-7H,(H,16,17)
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2-(3'，5'-Dichloro-[1，1'-biphenyl]-3-yl)acetic acidCas Number: 669713-80-8 Compound CID: 2758082Formula: C14H10Cl2O2 Molecular Weight: 281.13IUPAC Name: 2-[3-(3,5-dichlorophenyl)phenyl]acetic acidSMILES: C1=CC(=CC(=C1)C2=CC(=CC(=C2)Cl)Cl)CC(=O)OInChIKey: JCGACYUTIHYERA-UHFFFAOYSA-NInChI: InChI=1S/C14H10Cl2O2/c15-12-6-11(7-13(16)8-12)10-3-1-2-9(4-10)5-14(17)18/h1-4,6-8H,5H2,(H,17,18)
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1,1′-Biphenyl, 2,3′,6-trichloro-2,3',6-trichloro-1,1'-biphenylCas Number: 38444-76-7 Compound CID: 38030Formula: C12H7Cl3 Molecular Weight: 257.54IUPAC Name: 1,3-dichloro-2-(3-chlorophenyl)benzeneSMILES: ClC1C=C(C=CC=1)C2=C(Cl)C=CC=C2ClInChIKey: VQOFJPFYTCHPTR-UHFFFAOYSA-NInChI: InChI=1S/C12H7Cl3/c13-9-4-1-3-8(7-9)12-10(14)5-2-6-11(12)15/h1-7H
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PF-4693627Cas Number: 1312815-93-2 Compound CID: 53252516Formula: C26H29Cl2N3O3 Molecular Weight: 502.43IUPAC Name: 1-[5-chloro-6-(4-chlorophenyl)-1,3-benzoxazol-2-yl]-N-[(1S,3S)-3-(hydroxymethyl)cyclohexyl]piperidine-4-carboxamideSMILES: C1CC(CC(C1)NC(=O)C2CCN(CC2)C3=NC4=C(O3)C=C(C(=C4)Cl)C5=CC=C(C=C5)Cl)COInChIKey: CPDNPVKDQXLYHO-JXFKEZNVSA-NInChI: show more
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K-Ras G12C-IN-1Cas Number: 1629265-17-3 Compound CID: 90462972Formula: C22H23Cl2N3O3 Molecular Weight: 448.34IUPAC Name: 1-[4-[2-[4-chloro-5-(2-chlorophenyl)-2-methoxyanilino]acetyl]piperazin-1-yl]prop-2-en-1-oneSMILES: COC1=C(C=C(C(=C1)Cl)C2=CC=CC=C2Cl)NCC(=O)N3CCN(CC3)C(=O)C=CInChIKey: ZJWLFLPGQCYBSE-UHFFFAOYSA-NInChI: InChI=1S/C22H23Cl2N3O3/c1-3-21(28)26-8-10-27(11-9-26)22(29)14-25-19-12-16(18(24)13-20(19)30-2)15-6-4-5-7-17(15)23/h3-7,12-13,25H,1,8-11,14H2,2H3
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K-Ras G12C-IN-3Cas Number: 1629268-19-4 Compound CID: 92044410Formula: C21H19Cl3N2O3 Molecular Weight: 453.75IUPAC Name: 1-[4-[4-chloro-5-(2,5-dichlorophenyl)-2-methoxybenzoyl]piperazin-1-yl]prop-2-en-1-oneSMILES: COC1=C(C=C(C(=C1)Cl)C2=C(C=CC(=C2)Cl)Cl)C(=O)N3CCN(CC3)C(=O)C=CInChIKey: RPBHAPLCWWQJAK-UHFFFAOYSA-NInChI: InChI=1S/C21H19Cl3N2O3/c1-3-20(27)25-6-8-26(9-7-25)21(28)16-11-15(18(24)12-19(16)29-2)14-10-13(22)4-5-17(14)23/h3-5,10-12H,1,6-9H2,2H3Synonyms: 1-[4-[(2',5',6-Trichloro-4-methoxy[1,1'-biphenyl]-3-yl)carbonyl]-1-piperazinyl]-2-propen-1-one | HY-18606 | 1-[4-[4-c...
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PCB No 101 solutionCas Number: 37680-73-2 EC Number: 215-648-1Formula: C12H5Cl5 Molecular Weight: 326.43IUPAC Name: 1,2,4-trichloro-5-(2,5-dichlorophenyl)benzeneSMILES: C1=CC(=C(C=C1Cl)C2=CC(=C(C=C2Cl)Cl)Cl)ClInChIKey: LAHWLEDBADHJGA-UHFFFAOYSA-NInChI: InChI=1S/C12H5Cl5/c13-6-1-2-9(14)7(3-6)8-4-11(16)12(17)5-10(8)15/h1-5HSynonyms: 37680-73-2|2,2',4,5,5'-PENTACHLOROBIPHENYL|1,1'-Biphenyl, 2,2',4,5,5'-pentachloro-|PCB 101|2,4,5,2',5'-Pentachlorobip...
