Basic information
- Standard SMILES
Cc1cccc(-c2ccccc2C#N)c1- InChIKey
BITRDALNSYHNBR-UHFFFAOYSA-N- Molecular formula
- C14H11N
- Average molar mass
- 193.24 g/mol
Names & identifiers
- Preferred name
- 2-(3-Methylphenyl)benzonitrile
- IUPAC
- 2-(3-methylphenyl)benzonitrile
Names & synonyms
2-(3-methylphenyl)benzonitrile153959-55-83'-Methyl-[1,1'-biphenyl]-2-carbonitrile3'-Methyl[1,1'-biphenyl]-2-carbonitrile2-(m-Tolyl)benzonitrileSCHEMBL2183512SCHEMBL50037462-(3-methylphenyl)-benzonitrileBITRDALNSYHNBR-UHFFFAOYSA-N2-cyano-3'-methyl-1,1'-biphenylAKOS004118742DB-111519
Database identifiers
- PubChem CID
- 1394243
- Nikkaji
- J1.151.267D
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 23.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 249
Related reactions
12 records
Compound notes
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