4-Hydroxy-8-methylnona-3,5,7-trien-2-one
Basic information
- CAS
593288-46-1- Standard SMILES
CC(=O)C=C(O)C=CC=C(C)C- InChIKey
MMIQJWNHNFVCFI-UHFFFAOYSA-N- Molecular formula
- C10H14O2
- Average molar mass
- 166.22 g/mol
- Monoisotopic mass
- 166.09937969
Names & identifiers
- Preferred name
- 4-Hydroxy-8-methylnona-3,5,7-trien-2-one
- IUPAC
- 4-hydroxy-8-methylnona-3,5,7-trien-2-one
Names & synonyms
4-hydroxy-8-methylnona-3,5,7-trien-2-one593288-46-1DTXSID60787168
Database identifiers
- CAS
593288-46-1- PubChem CID
- 71363654
- DTXSID
DTXSID60787168
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 37.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 12
- Formal charge
- 0
- Complexity
- 241
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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