Carbonimidodithioic acid, [(4-methylphenyl)sulfonyl]-, dimethyl ester


Chemical Name: Carbonimidodithioic acid, [(4-methylphenyl)sulfonyl]-, dimethyl ester
CAS Number: 2651-15-2
Product Number: AG002THV(AGN-PC-0JOY2A)
Synonyms:
MDL No:
Molecular Formula: C10H13NO2S3
Molecular Weight: 275.4107

Identification/Properties


Properties
MP:
109-111℃ (lit.)
Form:
Solid
Computed Properties
Molecular Weight:
275.399g/mol
XLogP3:
3.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
4
Exact Mass:
275.011g/mol
Monoisotopic Mass:
275.011g/mol
Topological Polar Surface Area:
106A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
332
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


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



Dimethyl tosylcarbonimidodithioate is a versatile reagent commonly used in chemical synthesis for its unique properties and highly reactive nature. Its primary application lies in the process of sulfenylation, where it serves as an efficient source of sulfenyl groups. This compound is particularly useful in the introduction of sulfur-containing moieties into various organic molecules, offering a key building block for the synthesis of pharmaceuticals, agrochemicals, and materials. Additionally, dimethyl tosylcarbonimidodithioate is employed in the preparation of sulfenamides, sulfenyl chlorides, and sulfenyl hydrazides, among other sulfur-containing compounds, thus enabling the expansion of synthetic possibilities in the field of organic chemistry.