Molecule ID: 2537

IUPAC Name: 1,7,7-trimethylbicyclo[2.2.1]heptan-2-one

Description: The molecule is a cyclic monoterpene ketone that is bornane bearing an oxo substituent at position 2. A naturally occurring monoterpenoid. It has a role as a plant metabolite. It is a bornane monoterpenoid and a cyclic monoterpene ketone.

SMILES: CC12CCC(CC1=O)C2(C)C

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

InChI: InChI=1S/C10H16O/c1-9(2)7-4-5-10(9,3)8(11)6-7/h7H,4-6H2,1-3H3

Molecular Properties:
- Polar Surface Area: 17.1 Ų
- LogP: 2.2