Basic information
- Standard SMILES
COc1ccccc1CCC(C)=O- InChIKey
DUTRTHUPRZLRSD-UHFFFAOYSA-N- Molecular formula
- C11H14O2
- Average molar mass
- 178.23 g/mol
Names & identifiers
- Preferred name
- 4-(2-Methoxyphenyl)butan-2-one
- IUPAC
- 4-(2-methoxyphenyl)butan-2-one
Names & synonyms
4-(2-methoxyphenyl)butan-2-one63449-79-6DOBUTAMINE IMPURITY 332-Butanone, 4-(2-methoxyphenyl)-SCHEMBL266525SCHEMBL303651641-(o-methoxyphenyl)-3-butanone2-Butanone, 4-(2-methoxyphenyl)4-(2-Methoxyphenyl)-2-butanone #AKOS000348705G87547EN300-1843981
Database identifiers
- PubChem CID
- 578563
- Nikkaji
- J3.085.810G
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 165
Related reactions
5 records
Compound notes
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