2-[4-(2-Methylbutyryl)benzyl]anisole
Basic information
- Standard SMILES
CCC(C)C(=O)c1ccc(Cc2ccccc2OC)cc1- InChIKey
PJTCPTBTPDOKFT-UHFFFAOYSA-N- Molecular formula
- C19H22O2
- Average molar mass
- 282.4 g/mol
Names & identifiers
- Preferred name
- 2-[4-(2-Methylbutyryl)benzyl]anisole
- IUPAC
- 1-[4-[(2-methoxyphenyl)methyl]phenyl]-2-methylbutan-1-one
Names & synonyms
SCHEMBL6249337PJTCPTBTPDOKFT-UHFFFAOYSA-N2-[4-(2-Methylbutyryl)benzyl]anisole
Database identifiers
- PubChem CID
- 22380596
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 318
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Related reactions
2 records
Compound notes
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