Basic information
- CAS
32444-63-6- Standard SMILES
CN(C)c1ccc(C=CC#N)cc1- InChIKey
CSCOHKCYDZVRMQ-UHFFFAOYSA-N- Molecular formula
- C11H12N2
- Average molar mass
- 172.23 g/mol
- Monoisotopic mass
- 172.10004839
Names & identifiers
- Preferred name
- 3-[4-(Dimethylamino)phenyl]prop-2-enenitrile
- IUPAC
- 3-[4-(dimethylamino)phenyl]prop-2-enenitrile
Names & synonyms
3-[4-(dimethylamino)phenyl]prop-2-enenitrileMaybridge2_000149SCHEMBL531721AKOS034203072p-DimethylaminozimtsA currencyurenitrilSY533508
Database identifiers
- CAS
32444-63-6- PubChem CID
- 98404
- DTXSID
DTXSID201036230
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 27 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 213
Experimental & physicochemical properties
SpringerMaterials PropertiesAngular frequency
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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