1H-1,2,4-Triazole


Chemical Name: 1H-1,2,4-Triazole
CAS Number: 288-88-0
Product Number: AG002WJR(AGN-PC-02YT6N)
Synonyms:
MDL No:
Molecular Formula: C2H3N3
Molecular Weight: 69.0653

Identification/Properties


Properties
MP:
115-117 °C
BP:
260°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
1.4854 (estimate)
Solubility:
547g/l
Computed Properties
Molecular Weight:
69.067g/mol
XLogP3:
-0.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
69.033g/mol
Monoisotopic Mass:
69.033g/mol
Topological Polar Surface Area:
41.6A^2
Heavy Atom Count:
5
Formal Charge:
0
Complexity:
28.1
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-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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