Molecule ID: 61664

IUPAC Name: 2-methylthiolan-3-one

Description: The molecule is a member of the class of tetrahydrothiophenes that is thiolane substituted by a methyl group at position 2 and an oxo group at position 3 respectively. It has a role as a flavouring agent and a metabolite. It is a member of tetrahydrothiophenes and a cyclic ketone. It derives from a hydride of a tetrahydrothiophene.

SMILES: CC1SCCC1=O

SELFIES: [C][C][S][C][C][C][Ring1][Branch1][=O]

InChI: InChI=1S/C5H8OS/c1-4-5(6)2-3-7-4/h4H,2-3H2,1H3

Molecular Properties:
- Polar Surface Area: 42.4 Ų
- LogP: 0.8