3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one
Basic information
- CAS
70259-96-0- Standard SMILES
C=C1CCN(c2ccc([N+](=O)[O-])cc2)C1=O- InChIKey
VWTCSTOQBLMVNB-UHFFFAOYSA-N- Molecular formula
- C11H10N2O3
- Average molar mass
- 218.21 g/mol
- Monoisotopic mass
- 218.06914219
Names & identifiers
- Preferred name
- 3-Methylidene-1-(4-nitrophenyl)pyrrolidin-2-one
- IUPAC
- 3-methylidene-1-(4-nitrophenyl)pyrrolidin-2-one
Names & synonyms
3-methylidene-1-(4-nitrophenyl)pyrrolidin-2-one70259-96-0NSC276430DTXSID80313761NSC-276430DS-014298
Database identifiers
- CAS
70259-96-0- PubChem CID
- 321907
- DTXSID
DTXSID80313761
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 327
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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