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Halobenzenes
Description:
Aromatic compounds containing a halogen atom linked to a benzene ring.
Ancestors:
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1，4-Dibromo-2-fluoro-3-methylbenzeneCas Number: 1000576-44-2 Compound CID: 44891117Formula: C7H5Br2F Molecular Weight: 267.923IUPAC Name: 1,4-dibromo-2-fluoro-3-methylbenzeneSMILES: CC1=C(C=CC(=C1F)Br)BrInChIKey: DIHFJZRFCAKXCU-UHFFFAOYSA-NInChI: InChI=1S/C7H5Br2F/c1-4-5(8)2-3-6(9)7(4)10/h2-3H,1H3 -
1，3-DiiodotetrafluorobenzeneCas Number: 67815-57-0 Compound CID: 12543813Formula: C6F4I2 Molecular Weight: 401.87IUPAC Name: 1,2,3,5-tetrafluoro-4,6-diiodobenzeneSMILES: C1(=C(C(=C(C(=C1F)I)F)I)F)FInChIKey: FVJBAXUUZIEJCB-UHFFFAOYSA-NInChI: InChI=1S/C6F4I2/c7-1-2(8)5(11)4(10)6(12)3(1)9
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1，5-Dibromo-2，3-difluorobenzeneCas Number: 811713-09-4 Compound CID: 44891217Formula: C6H2Br2F2 Molecular Weight: 271.887IUPAC Name: 1,5-dibromo-2,3-difluorobenzeneSMILES: C1=C(C=C(C(=C1F)F)Br)BrInChIKey: ZZWOIZSMVMYOEW-UHFFFAOYSA-NInChI: InChI=1S/C6H2Br2F2/c7-3-1-4(8)6(10)5(9)2-3/h1-2H
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1，4-Dichloro-2，3，5，6-tetrafluoro-benzeneCas Number: 1198-62-5 Compound CID: 11085291Formula: C6Cl2F4 Molecular Weight: 218.96IUPAC Name: 1,4-dichloro-2,3,5,6-tetrafluorobenzeneSMILES: C1(=C(C(=C(C(=C1Cl)F)F)Cl)F)FInChIKey: HUBUEVKHTMIROY-UHFFFAOYSA-NInChI: InChI=1S/C6Cl2F4/c7-1-3(9)5(11)2(8)6(12)4(1)10
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2-(2-((2，6-Dichloro-4-hydroxyphenyl)amino)phenyl)acetic acidCas Number: 64118-84-9 Compound CID: 116545Formula: C14H11Cl2NO3 Molecular Weight: 312.15IUPAC Name: 2-[2-(2,6-dichloro-4-hydroxyanilino)phenyl]acetic acidSMILES: C1=CC=C(C(=C1)CC(=O)O)NC2=C(C=C(C=C2Cl)O)ClInChIKey: KGVXVPRLBMWZLG-UHFFFAOYSA-NInChI: InChI=1S/C14H11Cl2NO3/c15-10-6-9(18)7-11(16)14(10)17-12-4-2-1-3-8(12)5-13(19)20/h1-4,6-7,17-18H,5H2,(H,19,20)
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1-(3，4-difluorophenyl)cyclopropane-1-carbonitrileCas Number: 186347-65-9Formula: C10H7F2N Molecular Weight: 179.17SMILES: C1CC1(C#N)C2=CC(=C(C=C2)F)FInChIKey: BUYXKEPFKQYIEW-UHFFFAOYSA-NInChI: InChI=1S/C10H7F2N/c11-8-2-1-7(5-9(8)12)10(6-13)3-4-10/h1-2,5H,3-4H2
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1-Chloro-2，3，4-trifluorobenzeneCas Number: 36556-42-0 Compound CID: 142097Formula: C6H2ClF3 Molecular Weight: 166.53IUPAC Name: 1-chloro-2,3,4-trifluorobenzeneSMILES: C1=CC(=C(C(=C1F)F)F)ClInChIKey: QEIDAZALPGAFIS-UHFFFAOYSA-NInChI: InChI=1S/C6H2ClF3/c7-3-1-2-4(8)6(10)5(3)9/h1-2H
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1-(3-fluorophenyl)cyclobutane-1-carbonitrileCas Number: 179411-83-7Formula: C11H10FN Molecular Weight: 175.21SMILES: C1CC(C1)(C#N)C2=CC(=CC=C2)FInChIKey: GHKFTXRURFRWJR-UHFFFAOYSA-NInChI: InChI=1S/C11H10FN/c12-10-4-1-3-9(7-10)11(8-13)5-2-6-11/h1,3-4,7H,2,5-6H2
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1-(3-chlorophenyl)cyclobutane-1-carbonitrileCas Number: 28049-60-7Formula: C11H10ClN Molecular Weight: 191.66SMILES: C1CC(C1)(C#N)C2=CC(=CC=C2)ClInChIKey: HZMRYIISYHOTSF-UHFFFAOYSA-NInChI: InChI=1S/C11H10ClN/c12-10-4-1-3-9(7-10)11(8-13)5-2-6-11/h1,3-4,7H,2,5-6H2
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1-(4-fluorophenyl)cyclobutan-1-amine hydrochlorideCas Number: 1216658-90-0Formula: C10H13ClFN Molecular Weight: 201.67SMILES: C1CC(C1)(C2=CC=C(C=C2)F)N.ClInChIKey: UHGWAVIHBAZSMM-UHFFFAOYSA-NInChI: InChI=1S/C10H12FN.ClH/c11-9-4-2-8(3-5-9)10(12)6-1-7-10;/h2-5H,1,6-7,12H2;1H
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1-(3-chlorophenyl)cyclobutan-1-amine hydrochlorideCas Number: 959140-89-7 Compound CID: 53256949Formula: C10H13Cl2N Molecular Weight: 218.12IUPAC Name: 1-(3-chlorophenyl)cyclobutan-1-amine;hydrochlorideSMILES: C1CC(C1)(C2=CC(=CC=C2)Cl)N.ClInChIKey: CHXWZDHUSNSLLQ-UHFFFAOYSA-NInChI: InChI=1S/C10H12ClN.ClH/c11-9-4-1-3-8(7-9)10(12)5-2-6-10;/h1,3-4,7H,2,5-6,12H2;1H
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1-(3，5-difluorophenyl)cyclopropane-1-carbonitrileCas Number: 1205642-06-3Formula: C10H7F2N Molecular Weight: 179.17SMILES: C1CC1(C#N)C2=CC(=CC(=C2)F)FInChIKey: WHYHFQTUOOGNDA-UHFFFAOYSA-NInChI: InChI=1S/C10H7F2N/c11-8-3-7(4-9(12)5-8)10(6-13)1-2-10/h3-5H,1-2H2
