Molecule ID: 88290

IUPAC Name: 4-methyl-4-sulfanylpentan-2-one

Description: The molecule is an alkylthiol that is 4-methylpentan-2-one substituted at position 4 by a mercapto group. It has a role as a Saccharomyces cerevisiae metabolite and a plant metabolite. It is an alkanethiol and a methyl ketone.

SMILES: CC(=O)CC(C)(C)S

SELFIES: [C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][S]

InChI: InChI=1S/C6H12OS/c1-5(7)4-6(2,3)8/h8H,4H2,1-3H3

Molecular Properties:
- Polar Surface Area: 18.1 Ų
- LogP: 0.8