Molecule ID: 7460

IUPAC Name: 2-methyl-5-propan-2-ylcyclohexa-1,3-diene

Description: The molecule is one of a pair of phellandrene cyclic monoterpene double-bond isomers in which both double bonds are endocyclic (cf. alpha-phellandrene, where one of them is exocyclic). It has a role as a volatile oil component, a plant metabolite and an antimicrobial agent. It is a phellandrene and a cyclohexadiene.

SMILES: CC1=CCC(C(C)C)C=C1

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

InChI: InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4-6,8,10H,7H2,1-3H3

Molecular Properties:
- Polar Surface Area: 0.0 Ų
- LogP: 3.2