Basic information
- CAS
6476-18-2- Standard SMILES
O=C1NC(=O)C(c2ccccc2)C1=O- InChIKey
ZIQMDGHNRLGXRQ-UHFFFAOYSA-N- Molecular formula
- C10H7NO3
- Average molar mass
- 189.17 g/mol
- Monoisotopic mass
- 189.04259309
Names & identifiers
- Preferred name
- 4-Phenylpyrrolidine-2,3,5-trione
- IUPAC
- 4-phenylpyrrolidine-2,3,5-trione
Names & synonyms
6476-18-24-phenylpyrrolidine-2,3,5-trioneNSC404007DTXSID30323436NSC-404007
Database identifiers
- CAS
6476-18-2- PubChem CID
- 346010
- DTXSID
DTXSID30323436- Nikkaji
- J1.582.687H
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 63.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 292
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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