Basic information
- Standard SMILES
CCCCCC(=O)c1ccc(CC(C)C)cc1- InChIKey
DGNYSNMYAQGDJL-UHFFFAOYSA-N- Molecular formula
- C16H24O
- Average molar mass
- 232.36 g/mol
- Monoisotopic mass
- 232.18271539
Names & identifiers
- Preferred name
- 4'-Isobutylhexanophenone
- IUPAC
- 1-[4-(2-methylpropyl)phenyl]hexan-1-one
Names & synonyms
4'-isobutylhexanophenoneSCHEMBL8114139DGNYSNMYAQGDJL-UHFFFAOYSA-N
Database identifiers
- PubChem CID
- 10879019
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 212
Related reactions
8 records
Compound notes
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