Molecule ID: 545627

IUPAC Name: 4,6-dimethyldodecane

Description: The molecule is an alkane that is dodecane substituted by methyl groups at positions 4 and 6. Metabolite observed in cancer metabolism. It has a role as a human metabolite. It derives from a hydride of a dodecane.

SMILES: CCCCCCC(C)CC(C)CCC

SELFIES: [C][C][C][C][C][C][C][Branch1][C][C][C][C][Branch1][C][C][C][C][C]

InChI: InChI=1S/C14H30/c1-5-7-8-9-11-14(4)12-13(3)10-6-2/h13-14H,5-12H2,1-4H3

Molecular Properties:
- Polar Surface Area: 0.0 Ų
- LogP: 7.2