Molecule ID: 50986185

IUPAC Name: (1S,4R,4aS)-1,6-dimethyl-4-propan-2-yl-1,2,3,4,4a,7-hexahydronaphthalene

Description: The molecule is a sesquiterpene that is 1,6-dimethyl-4-(propan-2-yl)naphthalene in which the naphthalene ring has been hydrogenated at the 1, 2, 3, 4, 4a and 7 positions (the 1S,4R,4aS diastereoisomer). It is a sesquiterpene and a carbobicyclic compound.

SMILES: CC1=C[C@H]2C(=CC1)[C@@H](C)CC[C@@H]2C(C)C

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

InChI: InChI=1S/C15H24/c1-10(2)13-8-6-12(4)14-7-5-11(3)9-15(13)14/h7,9-10,12-13,15H,5-6,8H2,1-4H3/t12-,13+,15+/m0/s1

Molecular Properties:
- Polar Surface Area: 0.0 Ų
- LogP: 4.5