Basic information
- Standard SMILES
CCOC(=O)c1ccc(O)c(C)c1- InChIKey
JWDKYAFBFMULRY-UHFFFAOYSA-N- Molecular formula
- C10H12O3
- Average molar mass
- 180.2 g/mol
- Monoisotopic mass
- 180.07864424
Names & identifiers
- Preferred name
- Ethyl 4-hydroxy-3-methylbenzoate
- IUPAC
- ethyl 4-hydroxy-3-methylbenzoate
Names & synonyms
ETHYL 4-HYDROXY-3-METHYLBENZOATE69747-21-3SCHEMBL334524SCHEMBL68719364-Ethoxycarbonyl-2-methylphenolJWDKYAFBFMULRY-UHFFFAOYSA-Nethyl 4-hydroxy-3-methyl-benzoateAKOS006294005HS-3669F438106
Database identifiers
- PubChem CID
- 12465307
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 46.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 179
Related reactions
3 records
Compound notes
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