2-Cyano-4'-methylbiphenyl

• CAS: 114772-53-1
• Catalog Number: ACM114772531
• Category: Other
• Molecular Weight: 193.24g/mol
• Molecular Formula: C14H11N
• Synonyms: AKOS BAR-1203;4-METHYLBIPHENYL-2-CARBONITRILE;4-METHYL-2-BIPHENYLCARBONITRILE;4-METHYL-2-CYANOBIPHENYL;4-METHYL[1,1-BIPHENYL]-2-CARBONITRILE;2-(4-TOLYL)-BENZONITRILE;2-(4-METHYLPHENYL)BENZONITRILE;[2-(P-TOLYL)BENZONITRILE]
• IUPAC Name: 2-(4-methylphenyl)benzonitrile
• Canonical SMILES: CC1=CC=C(C=C1)C2=CC=CC=C2C#N
• InChI: InChI=1S/C14H11N/c1-11-6-8-12(9-7-11)14-5-3-2-4-13(14)10-15/h2-9H,1H3
• InChI Key: ZGQVZLSNEBEHFN-UHFFFAOYSA-N
• Complexity: 241
• Covalently-Bonded Unit Count: 1
• EC Number: 422-310-9;601-326-1
• Exact Mass: 193.089149g/mol
• Formal Charge: 0
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Heavy Atom Count: 15
• Monoisotopic Mass: 193.089149g/mol
• Rotatable Bond Count: 1
• UNII: O417TI15TA
• XLogP3: 3.8