Basic information
- CAS
58163-27-2- Standard SMILES
O=C(O)C=CC(=O)Oc1ccccc1- InChIKey
GPTNZCCQHNGXMS-UHFFFAOYSA-N- Molecular formula
- C10H8O4
- Average molar mass
- 192.17 g/mol
- Monoisotopic mass
- 192.04225873
Names & identifiers
- Preferred name
- 4-Oxo-4-phenoxybut-2-enoic acid
- IUPAC
- 4-oxo-4-phenoxybut-2-enoic acid
Names & synonyms
SCHEMBL528592
Database identifiers
- CAS
58163-27-2- PubChem CID
- 192207
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 239
Related reactions
1 records
Compound notes
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