2H-Imidazole-2-thione, 1,3-dihydro-1-methyl-


Chemical Name: 2H-Imidazole-2-thione, 1,3-dihydro-1-methyl-
CAS Number: 60-56-0
Product Number: AG00IAN2(AGN-PC-01ZDTC)
Synonyms:
MDL No:
Molecular Formula: C4H6N2S
Molecular Weight: 114.1688

Identification/Properties


Computed Properties
Molecular Weight:
114.166g/mol
XLogP3:
-0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
0
Exact Mass:
114.025g/mol
Monoisotopic Mass:
114.025g/mol
Topological Polar Surface Area:
47.4A^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:
H303-H317-H361
Precautionary Statements:
P201-P202-P261-P272-P280-P302+P352+P333+P313+P363-P308+P313-P405-P501
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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