Molecule ID: 39800

IUPAC Name: 2-methyl-1,2-thiazol-3-one

Description: The molecule is a 1,2-thazole that is 4-isothiazolin-3-one bearing a methyl group on the nitrogen atom. It is a powerful biocide and preservative and is the minor active ingredient in the commercial product Kathon(TM). It has a role as an antifouling biocide, an antimicrobial agent and an antifungal agent.

SMILES: Cn1sccc1=O

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

InChI: InChI=1S/C4H5NOS/c1-5-4(6)2-3-7-5/h2-3H,1H3

Molecular Properties:
- Polar Surface Area: 45.6 Ų
- LogP: 0.0