Basic information
- CAS
93919-06-3- Standard SMILES
O=C(O)C=CC(=O)OCc1ccccc1- InChIKey
QKUGKZFASYQCGO-UHFFFAOYSA-N- Molecular formula
- C11H10O4
- Average molar mass
- 206.19 g/mol
- Monoisotopic mass
- 206.0579088
Names & identifiers
- Preferred name
- 4-Oxo-4-phenylmethoxybut-2-enoic acid
- IUPAC
- 4-oxo-4-phenylmethoxybut-2-enoic acid
Names & synonyms
SCHEMBL527836NS00063862
Database identifiers
- CAS
93919-06-3- PubChem CID
- 106597
Properties
Computed structural properties
- XLogP
- 1.7
- Topological polar surface area
- 63.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 251
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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