Basic information
- Standard SMILES
C=CCOc1ccc(COOC(C)=O)cc1- InChIKey
RPZGDEXVULRWKA-UHFFFAOYSA-N- Molecular formula
- C12H14O4
- Average molar mass
- 222.24 g/mol
- Monoisotopic mass
- 222.08920892
Names & identifiers
- Preferred name
- 4-Allyloxyphenylmethyloxy acetate
- IUPAC
- (4-prop-2-enoxyphenyl)methyl ethaneperoxoate
Names & synonyms
SCHEMBL84216814-allyloxyphenylmethyloxy acetateRPZGDEXVULRWKA-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 86754162
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 44.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 219
Related reactions
1 records
Compound notes
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