Basic information
- CAS
70259-95-9- Standard SMILES
C=C1CCN(c2ccc(OCC)cc2)C1=O- InChIKey
BMHGZUCHUPUSPP-UHFFFAOYSA-N- Molecular formula
- C13H15NO2
- Average molar mass
- 217.26 g/mol
- Monoisotopic mass
- 217.11027872
Names & identifiers
- Preferred name
- 1-(4-Ethoxyphenyl)-3-methylidenepyrrolidin-2-one
- IUPAC
- 1-(4-ethoxyphenyl)-3-methylidenepyrrolidin-2-one
Names & synonyms
70259-95-91-(4-ethoxyphenyl)-3-methylidenepyrrolidin-2-oneNSC276429DTXSID20313760NSC-276429DS-0137142-PYRROLIDINONE,1-(4-ETHOXYPHENYL)-3-METHYLENE-
Database identifiers
- CAS
70259-95-9- PubChem CID
- 321906
- DTXSID
DTXSID20313760
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 29.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 280
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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