Basic information
- CAS
134979-03-6- Standard SMILES
CC(=O)O.CC(=O)Oc1ccccc1CCO- InChIKey
VUUSPUGUAUGJHV-UHFFFAOYSA-N- Molecular formula
- C12H16O5
- Average molar mass
- 240.25 g/mol
- Monoisotopic mass
- 240.09977361
Names & identifiers
- Preferred name
- Acetic acid;[2-(2-hydroxyethyl)phenyl] acetate
- IUPAC
- acetic acid;[2-(2-hydroxyethyl)phenyl] acetate
Names & synonyms
134979-03-6DTXSID20768211Acetic acid--2-(2-hydroxyethyl)phenyl acetate (1/1)
Database identifiers
- CAS
134979-03-6- PubChem CID
- 71341237
- DTXSID
DTXSID20768211
Properties
Computed structural properties
- Topological polar surface area
- 83.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 199
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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