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Chlorinated biphenyls
Description:
Organic compounds containing at least one chlorine atom 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 -
PCB No 2Cas Number: 2051-61-8 EC Number: 218-126-1Formula: C12H9Cl Molecular Weight: 188.65IUPAC Name: 1-chloro-3-phenylbenzeneSMILES: C1=CC=C(C=C1)C2=CC(=CC=C2)ClInChIKey: NMWSKOLWZZWHPL-UHFFFAOYSA-NInChI: InChI=1S/C12H9Cl/c13-12-8-4-7-11(9-12)10-5-2-1-3-6-10/h1-9HSynonyms: 3-Chlorobiphenyl | 3-PCB
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2'-Chloro-[1，1'-biphenyl]-3-carbaldehydeCas Number: 675596-30-2 Compound CID: 1393666Formula: C13H9ClO Molecular Weight: 216.66IUPAC Name: 3-(2-chlorophenyl)benzaldehydeSMILES: C1=CC=C(C(=C1)C2=CC=CC(=C2)C=O)ClInChIKey: BLNRHBKEFUOWHM-UHFFFAOYSA-NInChI: InChI=1S/C13H9ClO/c14-13-7-2-1-6-12(13)11-5-3-4-10(8-11)9-15/h1-9H
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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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4-Chloro-[1，1'-biphenyl]-3-carboxylic acidCas Number: 855207-59-9 Compound CID: 16768902Formula: C13H9ClO2 Molecular Weight: 232.66IUPAC Name: 2-chloro-5-phenylbenzoic acidSMILES: C1=CC=C(C=C1)C2=CC(=C(C=C2)Cl)C(=O)OInChIKey: VQEKSOLICHLCHS-UHFFFAOYSA-NInChI: InChI=1S/C13H9ClO2/c14-12-7-6-10(8-11(12)13(15)16)9-4-2-1-3-5-9/h1-8H,(H,15,16)
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4'-Chloro-2'-methoxy-[1,1'-biphenyl]-4-amineCas Number: 1334499-96-5 Compound CID: 54759086Formula: C13H12ClNO Molecular Weight: 233.69IUPAC Name: 4-(4-chloro-2-methoxyphenyl)anilineSMILES: COC1=C(C=CC(=C1)Cl)C2=CC=C(C=C2)NInChIKey: LXVLGXFUOKOIHA-UHFFFAOYSA-NInChI: InChI=1S/C13H12ClNO/c1-16-13-8-10(14)4-7-12(13)9-2-5-11(15)6-3-9/h2-8H,15H2,1H3
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3-(4-chloro-2-methyl-phenyl)benzoic acidCas Number: 916220-05-8 Compound CID: 46238392Formula: C14H11ClO2 Molecular Weight: 246.69IUPAC Name: 3-(4-chloro-2-methylphenyl)benzoic acidSMILES: CC1=C(C=CC(=C1)Cl)C2=CC(=CC=C2)C(=O)OInChIKey: DFYRPLGXXFUTLB-UHFFFAOYSA-NInChI: InChI=1S/C14H11ClO2/c1-9-7-12(15)5-6-13(9)10-3-2-4-11(8-10)14(16)17/h2-8H,1H3,(H,16,17)
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ClozicCas Number: 22494-47-9 Compound CID: 71697Formula: C17H17ClO3 Molecular Weight: 304.8IUPAC Name: 2-[[4-(4-chlorophenyl)phenyl]methoxy]-2-methylpropanoic acidSMILES: CC(C)(C(=O)O)OCC1=CC=C(C=C1)C2=CC=C(C=C2)ClInChIKey: UGOFYAXVVVXMQT-UHFFFAOYSA-NInChI: InChI=1S/C17H17ClO3/c1-17(2,16(19)20)21-11-12-3-5-13(6-4-12)14-7-9-15(18)10-8-14/h3-10H,11H2,1-2H3,(H,19,20)
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3-Chloro-[1，1'-biphenyl]-4-carbaldehydeCas Number: 79213-60-8 Compound CID: 21441284Formula: C13H9ClO Molecular Weight: 216.66IUPAC Name: 2-chloro-4-phenylbenzaldehydeSMILES: C1=CC=C(C=C1)C2=CC(=C(C=C2)C=O)ClInChIKey: VGRMQYYLRHRMPS-UHFFFAOYSA-NInChI: InChI=1S/C13H9ClO/c14-13-8-11(6-7-12(13)9-15)10-4-2-1-3-5-10/h1-9H
