Benzenamine, 2-(1H-1,2,4-triazol-1-yl)-5-(trifluoromethyl)-


Chemical Name: Benzenamine, 2-(1H-1,2,4-triazol-1-yl)-5-(trifluoromethyl)-
CAS Number: 438019-67-1
Product Number: AG00I8CJ(AGN-PC-0KEVYN)
Synonyms:
MDL No: MFCD02712729
Molecular Formula: C9H7F3N4
Molecular Weight: 228.1739

Identification/Properties


Computed Properties
Molecular Weight:
228.178g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
228.062g/mol
Monoisotopic Mass:
228.062g/mol
Topological Polar Surface Area:
56.7A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
245
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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