Molecule ID: 6544

IUPAC Name: 3,5,5-trimethylcyclohex-2-en-1-one

Description: The molecule is a cyclic ketone, the structure of which is that of cyclohex-2-en-1-one substituted by methyl groups at positions 3, 5 and 5. It has a role as a solvent and a plant metabolite. It is a cyclic ketone and an enone.

SMILES: CC1=CC(=O)CC(C)(C)C1

SELFIES: [C][C][=C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][Ring1][=Branch2]

InChI: InChI=1S/C9H14O/c1-7-4-8(10)6-9(2,3)5-7/h4H,5-6H2,1-3H3

Molecular Properties:
- Polar Surface Area: 17.1 Ų
- LogP: 1.6