Molecule ID: 439711

IUPAC Name: (1S,2S,4R)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-ol

Description: The molecule is a fenchane monoterpenoid that is bicyclo[2.2.1]heptane substituted by methyl groups at positions 1, 3 and 3 and a hydroxy group at position 2 (the 1S,2S,4R stereoisomer). It has a role as a plant metabolite and a volatile oil component. It is a fenchane monoterpenoid and a carbobicyclic compound.

SMILES: CC1(C)[C@@H]2CC[C@@](C)(C2)[C@@H]1O

SELFIES: [C][C][Branch1][C][C][C@@H1][C][C][C@@][Branch1][C][C][Branch1][Ring2][C][Ring1][=Branch1][C@@H1][Ring1][=Branch2][O]

InChI: InChI=1S/C10H18O/c1-9(2)7-4-5-10(3,6-7)8(9)11/h7-8,11H,4-6H2,1-3H3/t7-,8-,10+/m1/s1

Molecular Properties:
- Polar Surface Area: 20.2 Ų
- LogP: 2.5