Basic information
- CAS
19990-28-4- Standard SMILES
CC(=O)c1ccc(N=C2C=CC(=O)O2)cc1- InChIKey
MPTUIJQPDQJRHN-UHFFFAOYSA-N- Molecular formula
- C12H9NO3
- Average molar mass
- 215.2 g/mol
- Monoisotopic mass
- 215.05824315
Names & identifiers
- Preferred name
- 5-(4-Acetylphenyl)iminofuran-2-one
- IUPAC
- 5-(4-acetylphenyl)iminofuran-2-one
Names & synonyms
19990-28-4NSC144232CHEMBL1078796NSC-144232
Database identifiers
- CAS
19990-28-4- PubChem CID
- 286295
- ChEMBL
CHEMBL1078796
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 55.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 362
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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