3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-methyl-


Chemical Name: 3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-methyl-
CAS Number: 24854-43-1
Product Number: AG003LPA(AGN-PC-0K2OC9)
Synonyms:
MDL No:
Molecular Formula: C3H5N3S
Molecular Weight: 115.1569

Identification/Properties


Properties
MP:
165-169°C
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Solubility:
acetone: soluble2.5%, clear, colorless to faintly yellow
Computed Properties
Molecular Weight:
115.154g/mol
XLogP3:
0
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
115.02g/mol
Monoisotopic Mass:
115.02g/mol
Topological Polar Surface Area:
59.7A^2
Heavy Atom Count:
7
Formal Charge:
0
Complexity:
119
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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