2-Methanesulfonylethanethioamide

Base Information

• Chemical Name: 2-Methanesulfonylethanethioamide
• CAS No.: 53300-47-3
• Molecular Formula: C3H7NO2S2
• Molecular Weight: 153.22
• DSSTox Substance ID: DTXSID50372562
• Wikidata: Q82160343
• Mol file: 53300-47-3.mol

Synonyms:53300-47-3;2-methanesulfonylethanethioamide;2-methylsulfonylethanethioamide;2-Methanesulfonyl-thioacetamide;2-(Methylsulphonyl)thioacetamide;2-(methylsulfonyl)ethanethioamide;Maybridge1_008817;methylsulfonyl-thioacetamide;SCHEMBL2086902;SCHEMBL12914481;HMS566I17;DTXSID50372562;SWXPAPNPQXSLMV-UHFFFAOYSA-N;MFCD00085139;AKOS010603754;AT35180;CS-0262537;FT-0721985;EN300-83091;Z803153250;6-METHYL-3,4-DIHYDRO-2H-BENZO[1,4]OXAZINEHYDROCHLORIDE

Chemical Property of 2-Methanesulfonylethanethioamide

Chemical Property:

• Vapor Pressure: 6.29E-06mmHg at 25°C
• Melting Point: 45-47°C
• Refractive Index: 1.572
• Boiling Point: 378.4°C at 760 mmHg
• Flash Point: 182.7°C
• PSA: 100.63000
• Density: 1.421g/cm³
• LogP: 1.09820
• XLogP3: -0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 152.99182081
• Heavy Atom Count: 8
• Complexity: 176

Purity/Quality:

97% ^*data from raw suppliers

2-Methanesulfonyl-thioacetamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CS(=O)(=O)CC(=S)N