Basic information
- CAS
88952-20-9- Standard SMILES
COc1cccc(C(=O)Oc2c(C)cc(C)cc2C(C)=O)c1- InChIKey
ZHRDANHXHVHGCG-UHFFFAOYSA-N- Molecular formula
- C18H18O4
- Average molar mass
- 298.3 g/mol
- Monoisotopic mass
- 298.12050905
Names & identifiers
- Preferred name
- 2-Acetyl-4,6-dimethylphenyl 3-methoxybenzoate
- IUPAC
- (2-acetyl-4,6-dimethylphenyl) 3-methoxybenzoate
Names & synonyms
88952-20-92-Acetyl-4,6-dimethylphenyl 3-methoxybenzoateDTXSID10526024
Database identifiers
- CAS
88952-20-9- PubChem CID
- 13190823
- DTXSID
DTXSID10526024
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 406
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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