1,3,4-Thiadiazole-2(3H)-thione, 5-(methylthio)-


Chemical Name: 1,3,4-Thiadiazole-2(3H)-thione, 5-(methylthio)-
CAS Number: 6264-40-0
Product Number: AG003MWL(AGN-PC-0K2G2W)
Synonyms:
MDL No:
Molecular Formula: C3H4N2S3
Molecular Weight: 164.2723

Identification/Properties


Properties
MP:
138-141 °C(lit.)
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
164.259g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
163.954g/mol
Monoisotopic Mass:
163.954g/mol
Topological Polar Surface Area:
107A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
142
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#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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