Basic information
- Standard SMILES
CCC(=O)C1=C(O)C(=O)NC1- InChIKey
QZQWVFYTFCSQID-UHFFFAOYSA-N- Molecular formula
- C7H9NO3
- Average molar mass
- 155.15 g/mol
- Monoisotopic mass
- 155.05824315
Names & identifiers
- Preferred name
- 3-Hydroxy-2-oxo-4-propionyl-2,5-dihydropyrrole
- IUPAC
- 4-hydroxy-3-propanoyl-1,2-dihydropyrrol-5-one
Names & synonyms
SCHEMBL7424240QZQWVFYTFCSQID-UHFFFAOYSA-N3-Hydroxy-2-oxo-4-propionyl-2,5-dihydropyrrole
Database identifiers
- PubChem CID
- 23355437
Properties
Computed structural properties
- XLogP
- -0.1
- Topological polar surface area
- 66.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 242
Related reactions
2 records
Compound notes
Loading…