Results for:
PubChem ID: 545370

2,2-dimethylpropanethioic S-acid

Compound Details

Synonymous names	Trimethylthioacetic S-acid Thiopivalic acid 55561-02-9 2,2-dimethylpropanethioic S-acid Propanethioic acid, 2,2-dimethyl- EINECS 259-708-5 thiopivaloic acid dimethylthio-propanoic acid SCHEMBL193559 2,2-Dimethylpropanethioic o-acid DTXSID50204117 2,2-Dimethylpropanethioic o-acid # AKOS006283051 AKOS015919031 NS00033340 EN300-187146 A830705 J-525115
Microorganism:	Yes
IUPAC name	2,2-dimethylpropanethioic S-acid
SMILES	CC(C)(C)C(=O)S
Inchi	InChI=1S/C5H10OS/c1-5(2,3)4(6)7/h1-3H3,(H,6,7)
Formula	C5H10OS
PubChem ID	545370
Molweight	118.2
LogP	1.7
Atoms	7
Bonds	1
H-bond Acceptor	2
H-bond Donor	1
Chemical Classification	acids sulfur compounds thiocarboxylic acids

mVOC Specific Details

Species emitting the compound	Kingdom Species Biological Function Origin/Habitat Reference Prokaryota Clostridium Difficile outbreak 2006 UK Rees et al. 2016 Microbacterium Ballot et al. 2023
Method	Kingdom Species Growth Medium Applied Method Verification Prokaryota Clostridium Difficile brain heart infusion GCxGC-TOF-MS yes Microbacterium tryptone soy (TS medium; Carl Roth, Karlsruhe, Germany) GC-QQQ-MS no