4-bromo-1-methyl-1H-1,2,3-benzotriazole


Chemical Name: 4-bromo-1-methyl-1H-1,2,3-benzotriazole
CAS Number: 1378259-89-2
Product Number: AG01B6JE(AG01B6JE)
Synonyms:
MDL No:
Molecular Formula: C7H6BrN3
Molecular Weight: 212.0466

Identification/Properties


Computed Properties
Molecular Weight:
212.05g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
0
Exact Mass:
210.975g/mol
Monoisotopic Mass:
210.975g/mol
Topological Polar Surface Area:
30.7A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
153
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


NMR Spectrum


Other Analytical Data


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