3,5-Dithiahexan-2-one structure

3,5-Dithiahexan-2-one

S-(methylsulfanylmethyl) ethanethioate

Also Known As: 3,5-dithiahexan-2-one|Methylthiomethyl acetyl sulfide|Fema No. 4817|S-((Methylthio)methyl)thioacetate|(Methylthio)methylthiolacetate|acetylsulfanyl-methylsulfanyl-methane|S-(methylsulfanylmethyl) ethanethioate|methylsulfanylmethyl 2-thiophen-2-ylacetate|Ethanethioic acid, S-((methylthio)methyl) ester|S-[(Methylsulfanyl)methyl] ethanethioate|Thioacetic acid S-(methylthio)methyl ester|Ethanethioic acid, S-[(methylthio)methyl] ester|S-[(Methylsulfanyl)methyl] ethanethioate #|Ethanethioic acid S-[(methylthio)methyl] ester|1-{[(methylsulfanyl)methyl]sulfanyl}ethan-1-one

CAS: 38634-59-2
Molecular Formula C4H8OS2
Molecular Weight 136.00166 g/mol
LogP 1.4
Topological Polar Surface Area 67.7 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 3
Rotatable Bonds 3
Exact Mass 136.00166
Monoisotopic Mass 136.00166
Heavy Atoms 7
Complexity 62.0

Chemical Identifiers

CAS Number 38634-59-2
SMILES CC(=O)SCSC
InChIKey NBPHYHUSNPKGSU-UHFFFAOYSA-N

Patent-Derived Application Labels

Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.

Agrochemicals (1 patents) Biotechnology (2 patents) Heterocyclic Building Blocks (2 patents) Organic Building Blocks (9 patents) Pharmaceutical Intermediates (5 patents)

Product Overview

3,5-Dithiahexan-2-one (CAS 38634-59-2), with molecular formula C4H8OS2 and molecular weight 136.00166 g/mol. IUPAC: S-(methylsulfanylmethyl) ethanethioate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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