3H-1,2,4-Triazole-3-thione, 4-amino-5-(2-furanyl)-2,4-dihydro-


Chemical Name: 3H-1,2,4-Triazole-3-thione, 4-amino-5-(2-furanyl)-2,4-dihydro-
CAS Number: 80809-38-7
Product Number: AG005J0Z(AGN-PC-0JUISX)
Synonyms:
MDL No:
Molecular Formula: C6H6N4OS
Molecular Weight: 182.2030

Identification/Properties


Properties
Form:
Solid
Computed Properties
Molecular Weight:
182.201g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
182.026g/mol
Monoisotopic Mass:
182.026g/mol
Topological Polar Surface Area:
98.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
242
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:
H319
Precautionary Statements:
P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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