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Halobenzenes
Description:
Aromatic compounds containing a halogen atom linked to a benzene ring.
Ancestors:
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4-(3-fluorophenyl)tetrahydro-2H-pyran-4-carbonitrileCas Number: 1035261-79-0 Compound CID: 43119033Formula: C12H12FNO Molecular Weight: 205.232IUPAC Name: 4-(3-fluorophenyl)oxane-4-carbonitrileSMILES: C1COCCC1(C#N)C2=CC(=CC=C2)FInChIKey: ISKQMVJXZOBQJH-UHFFFAOYSA-NInChI: InChI=1S/C12H12FNO/c13-11-3-1-2-10(8-11)12(9-14)4-6-15-7-5-12/h1-3,8H,4-7H2 -
3，4-Dichlorobenzene-1-carboximidamide hydrochlorideCas Number: 50292-25-6 Compound CID: 12301246Formula: C7H7Cl3N2 Molecular Weight: 225.5IUPAC Name: 3,4-dichlorobenzenecarboximidamide;hydrochlorideSMILES: C1=CC(=C(C=C1C(=N)N)Cl)Cl.ClInChIKey: BMKBQAJRZBGARG-UHFFFAOYSA-NInChI: InChI=1S/C7H6Cl2N2.ClH/c8-5-2-1-4(7(10)11)3-6(5)9;/h1-3H,(H3,10,11);1H
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3，5-Dichloro-2-hydroxybenzonitrileCas Number: 3336-32-1 Compound CID: 21432660Formula: C7H3Cl2NO Molecular Weight: 188.01IUPAC Name: 3,5-dichloro-2-hydroxybenzonitrileSMILES: C1=C(C=C(C(=C1C#N)O)Cl)ClInChIKey: ZTQVCIUXSLXAPV-UHFFFAOYSA-NInChI: InChI=1S/C7H3Cl2NO/c8-5-1-4(3-10)7(11)6(9)2-5/h1-2,11H
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4-(2-fluorophenyl)tetrahydro-2H-pyran-4-carbonitrileCas Number: 859164-45-7Formula: C12H12FNO Molecular Weight: 205.09SMILES: C1COCCC1(C#N)C2=CC=CC=C2FInChIKey: JOYSNTZJNYCWMW-UHFFFAOYSA-NInChI: InChI=1S/C12H12FNO/c13-11-4-2-1-3-10(11)12(9-14)5-7-15-8-6-12/h1-4H,5-8H2
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2，6-Dichloro-4-(perfluoropropan-2-yl)anilineCas Number: 273735-64-1 Compound CID: 10019496Formula: C9H4Cl2F7N Molecular Weight: 330.03IUPAC Name: 2,6-dichloro-4-(1,1,1,2,3,3,3-heptafluoropropan-2-yl)anilineSMILES: C1=C(C=C(C(=C1Cl)N)Cl)C(C(F)(F)F)(C(F)(F)F)FInChIKey: NXWRKJGSRUCYEN-UHFFFAOYSA-NInChI: InChI=1S/C9H4Cl2F7N/c10-4-1-3(2-5(11)6(4)19)7(12,8(13,14)15)9(16,17)18/h1-2H,19H2
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2，5-Bis(3-bromophenyl)-1，3，4-oxadiazoleCas Number: 84832-73-5 Compound CID: 259341Formula: C14H8Br2N2O Molecular Weight: 380.03IUPAC Name: 2,5-bis(3-bromophenyl)-1,3,4-oxadiazoleSMILES: C1=CC(=CC(=C1)Br)C2=NN=C(O2)C3=CC(=CC=C3)BrInChIKey: OLBIUUBQSQBMDC-UHFFFAOYSA-NInChI: InChI=1S/C14H8Br2N2O/c15-11-5-1-3-9(7-11)13-17-18-14(19-13)10-4-2-6-12(16)8-10/h1-8H
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2，5-Dichloro-4-hydroxybenzonitrileCas Number: 3336-18-3 Compound CID: 21323083Formula: C7H3Cl2NO Molecular Weight: 188.01IUPAC Name: 2,5-dichloro-4-hydroxybenzonitrileSMILES: C1=C(C(=CC(=C1Cl)O)Cl)C#NInChIKey: LIDUSYSXQFAHHK-UHFFFAOYSA-NInChI: InChI=1S/C7H3Cl2NO/c8-5-2-7(11)6(9)1-4(5)3-10/h1-2,11H
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2，4-Dichloro-N-[(2，4-dichlorophenyl)methyl]-N-hydroxybenzenemethanamineCas Number: 51850-95-4 Compound CID: 23498000Formula: C14H11Cl4NO Molecular Weight: 351.06IUPAC Name: N,N-bis[(2,4-dichlorophenyl)methyl]hydroxylamineSMILES: C1=CC(=C(C=C1Cl)Cl)CN(CC2=C(C=C(C=C2)Cl)Cl)OInChIKey: UCOJEGLSMUGXIF-UHFFFAOYSA-NInChI: InChI=1S/C14H11Cl4NO/c15-11-3-1-9(13(17)5-11)7-19(20)8-10-2-4-12(16)6-14(10)18/h1-6,20H,7-8H2
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2，4-dichlorostyreneCas Number: 2123-27-5Formula: C8H6Cl2 Molecular Weight: 173.0392SMILES: C=CC1=C(C=C(C=C1)Cl)ClInChIKey: OMNYXCUDBQKCMU-UHFFFAOYSA-NInChI: InChI=1S/C8H6Cl2/c1-2-6-3-4-7(9)5-8(6)10/h2-5H,1H2
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2-Bromo-4-chloro-6-iodoanilineCas Number: 71757-16-9 Compound CID: 20216596Formula: C6H4BrClIN Molecular Weight: 332.36IUPAC Name: 2-bromo-4-chloro-6-iodoanilineSMILES: C1=C(C=C(C(=C1Br)N)I)ClInChIKey: KGJQFAVZGHPELU-UHFFFAOYSA-NInChI: InChI=1S/C6H4BrClIN/c7-4-1-3(8)2-5(9)6(4)10/h1-2H,10H2
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2-Bromo-1-chloro-3，4-difluorobenzeneCas Number: 1208077-25-1 Compound CID: 50998371Formula: C6H2BrClF2 Molecular Weight: 227.43IUPAC Name: 2-bromo-1-chloro-3,4-difluorobenzeneSMILES: C1=CC(=C(C(=C1F)F)Br)ClInChIKey: MWGRISBCIIDKSD-UHFFFAOYSA-NInChI: InChI=1S/C6H2BrClF2/c7-5-3(8)1-2-4(9)6(5)10/h1-2H
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1，3-Dibromo-4，6-Bis(Acetamido)BenzeneCas Number: 132530-67-7 Compound CID: 15020094Formula: 10H10Br2N2O2IUPAC Name: N-(5-acetamido-2,4-dibromophenyl)acetamideSMILES: CC(=O)NC1=CC(=C(C=C1Br)Br)NC(=O)CInChIKey: ZESMJYDAJIBPHA-UHFFFAOYSA-NInChI: InChI=1S/C10H10Br2N2O2/c1-5(15)13-9-4-10(14-6(2)16)8(12)3-7(9)11/h3-4H,1-2H3,(H,13,15)(H,14,16)
