Basic information
- Standard SMILES
CCc1cccc(NC#N)c1- InChIKey
YVJXKCCZOVMOTD-UHFFFAOYSA-N- Molecular formula
- C9H10N2
- Average molar mass
- 146.19 g/mol
- Monoisotopic mass
- 146.08439833
Names & identifiers
- Preferred name
- [(3-Ethylphenyl)amino]carbonitrile
- IUPAC
- (3-ethylphenyl)cyanamide
Names & synonyms
[(3-ethylphenyl)amino]carbonitrile137160-24-8[(3-ethylphenyl)amino]formonitrilem-ethylphenylcyanamide3-ethylphenylcyanamideSCHEMBL7201873YVJXKCCZOVMOTD-UHFFFAOYSA-NAKOS011771903EN300-102458
Database identifiers
- PubChem CID
- 10012043
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 35.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 156
Related reactions
22 records
Compound notes
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