Basic information
- CAS
7476-32-6- Standard SMILES
CCC(=O)C(CC)(OC)c1ccccc1- InChIKey
MWGLKUPABDFFED-UHFFFAOYSA-N- Molecular formula
- C13H18O2
- Average molar mass
- 206.28 g/mol
- Monoisotopic mass
- 206.13067981
Names & identifiers
- Preferred name
- 4-Methoxy-4-phenylhexan-3-one
- IUPAC
- 4-methoxy-4-phenylhexan-3-one
Names & synonyms
7476-32-64-methoxy-4-phenylhexan-3-oneNSC401756DTXSID10322649NSC-401756
Database identifiers
- CAS
7476-32-6- PubChem CID
- 344692
- DTXSID
DTXSID10322649
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 207
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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