Basic information
- Standard SMILES
COc1ccc(-c2ccc(C(C)=O)cc2OC)cc1- InChIKey
KEBFXMBUBXAYKL-UHFFFAOYSA-N- Molecular formula
- C16H16O3
- Average molar mass
- 256.3 g/mol
- Monoisotopic mass
- 256.10994437
Names & identifiers
- Preferred name
- 1-[3-Methoxy-4-(4-methoxyphenyl)phenyl]ethanone
- IUPAC
- 1-[3-methoxy-4-(4-methoxyphenyl)phenyl]ethanone
Database identifiers
- PubChem CID
- 21523024
- Nikkaji
- J2.660.155J
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 35.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 294
Related reactions
1 records
Compound notes
Loading…