Basic information
- CAS
73640-03-6- Standard SMILES
CCOC(=O)C(O)(C(=O)OCC)c1ccccc1- InChIKey
BXDHPFGRKARXAL-UHFFFAOYSA-N- Molecular formula
- C13H16O5
- Average molar mass
- 252.26 g/mol
- Monoisotopic mass
- 252.09977361
Names & identifiers
- Preferred name
- Diethyl hydroxy(phenyl)propanedioate
- IUPAC
- diethyl 2-hydroxy-2-phenylpropanedioate
Names & synonyms
diethyl hydroxy(phenyl)propanedioate73640-03-6DTXSID30297441RefChem:337997DTXCID70248578NSC116011SCHEMBL10812584NSC-116011
Database identifiers
- CAS
73640-03-6- PubChem CID
- 271981
- DTXSID
DTXSID30297441- Nikkaji
- J2.656.836F
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 72.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 276
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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