Methanesulfonothioic acid, S-methyl ester


Chemical Name: Methanesulfonothioic acid, S-methyl ester
CAS Number: 2949-92-0
Product Number: AG002YKK(AGN-PC-0JKDUS)
Synonyms:
MDL No:
Molecular Formula: C2H6O2S2
Molecular Weight: 126.1978

Identification/Properties


Properties
BP:
266.9°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.513(lit.)
Solubility:
chloroform: soluble750mg + 5 ml Chloroformmg/mL, colorless to light greenish-yellow
Computed Properties
Molecular Weight:
126.188g/mol
XLogP3:
0
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
125.981g/mol
Monoisotopic Mass:
125.981g/mol
Topological Polar Surface Area:
67.8A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
106
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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