1,2-Benzenediamine, 4-bromo-3-nitro-


Chemical Name: 1,2-Benzenediamine, 4-bromo-3-nitro-
CAS Number: 147021-89-4
Product Number: AG001EIH(AGN-PC-003H21)
Synonyms:
MDL No:
Molecular Formula: C6H6BrN3O2
Molecular Weight: 232.0347

Identification/Properties


Computed Properties
Molecular Weight:
232.037g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
0
Exact Mass:
230.964g/mol
Monoisotopic Mass:
230.964g/mol
Topological Polar Surface Area:
97.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
184
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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