Basic information
- CAS
93445-22-8- Standard SMILES
CCC1=C(C)CC(C)CC1=O- InChIKey
HOWVKJXTFWYJAF-UHFFFAOYSA-N- Molecular formula
- C10H16O
- Average molar mass
- 152.23 g/mol
- Monoisotopic mass
- 152.12011513
Names & identifiers
- Preferred name
- 2-Ethyl-3,5-dimethylcyclohex-2-en-1-one
- IUPAC
- 2-ethyl-3,5-dimethylcyclohex-2-en-1-one
Names & synonyms
93445-22-82-ethyl-3,5-dimethylcyclohex-2-en-1-oneNSC10130DTXSID50278797NSC-10130DS-0132262-Ethyl-3,5-dimethyl-cyclohex-2-en-1-one
Database identifiers
- CAS
93445-22-8- PubChem CID
- 222995
- DTXSID
DTXSID50278797
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 11
- Formal charge
- 0
- Complexity
- 201
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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