Carbonimidodithioic acid, cyano-, dimethyl ester


Chemical Name: Carbonimidodithioic acid, cyano-, dimethyl ester
CAS Number: 10191-60-3
Product Number: AG003PLU(AGN-PC-0JL73J)
Synonyms:
MDL No:
Molecular Formula: C4H6N2S2
Molecular Weight: 146.2338

Identification/Properties


Properties
MP:
45-50 °C
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.5000 (estimate)
Solubility:
Slightly soluble in methanol.
Computed Properties
Molecular Weight:
146.226g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
145.997g/mol
Monoisotopic Mass:
145.997g/mol
Topological Polar Surface Area:
86.8A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
126
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:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H317-H319
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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