1H-1,2,4-Triazole, 1-[4-(chloromethyl)phenyl]-


Chemical Name: 1H-1,2,4-Triazole, 1-[4-(chloromethyl)phenyl]-
CAS Number: 143426-53-3
Product Number: AG006V0C(AGN-PC-0559RT)
Synonyms:
MDL No:
Molecular Formula: C9H8ClN3
Molecular Weight: 193.6329

Identification/Properties


Properties
BP:
355.8°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
193.634g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
193.041g/mol
Monoisotopic Mass:
193.041g/mol
Topological Polar Surface Area:
30.7A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
157
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:
Danger
UN#:
3261
Hazard Statements:
H302-H314
Precautionary Statements:
P280-P305+P351+P338-P310
Class:
8
Packing Group:

NMR Spectrum


Other Analytical Data


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