Basic information
- Standard SMILES
CCOC(=O)Cc1cc(O)cc(O)c1- InChIKey
IDZMZHPTOBCJDG-UHFFFAOYSA-N- Molecular formula
- C10H12O4
- Average molar mass
- 196.2 g/mol
- Monoisotopic mass
- 196.07355886
Names & identifiers
- Preferred name
- Ethyl 2-(3,5-dihydroxyphenyl)acetate
- IUPAC
- ethyl 2-(3,5-dihydroxyphenyl)acetate
Names & synonyms
ethyl 2-(3,5-dihydroxyphenyl)acetate66761-55-5SCHEMBL9202564ethyl 3,5-dihydroxyphenylacetateEthyl (3,5-dihydroxyphenyl)acetate #Benzeneacetic acid, 3,5-dihydroxy-, ethyl ester
Database identifiers
- PubChem CID
- 579799
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 183
Related reactions
2 records
Compound notes
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