4H-1,2,4-Triazole, 4-methyl-


Chemical Name: 4H-1,2,4-Triazole, 4-methyl-
CAS Number: 10570-40-8
Product Number: AG0091Z8(AGN-PC-0JL74Z)
Synonyms:
MDL No:
Molecular Formula: C3H5N3
Molecular Weight: 83.0919

Identification/Properties


Computed Properties
Molecular Weight:
83.094g/mol
XLogP3:
-0.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
83.048g/mol
Monoisotopic Mass:
83.048g/mol
Topological Polar Surface Area:
30.7A^2
Heavy Atom Count:
6
Formal Charge:
0
Complexity:
39.3
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:
H302-H315-H319-H332-H335
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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