2(3H)-Thiazolethione


Chemical Name: 2(3H)-Thiazolethione
CAS Number: 5685-05-2
Product Number: AG00E8ML(AGN-PC-0K1Y06)
Synonyms:
MDL No:
Molecular Formula: C3H3NS2
Molecular Weight: 117.19262

Identification/Properties


Computed Properties
Molecular Weight:
117.184g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
116.971g/mol
Monoisotopic Mass:
116.971g/mol
Topological Polar Surface Area:
69.4A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
97
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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