1-N-methyl-4-nitrobenzene-1,2-diamine


Chemical Name: 1-N-methyl-4-nitrobenzene-1,2-diamine
CAS Number: 41939-61-1
Product Number: AG00C6U1(AGN-PC-0KU3HW)
Synonyms:
MDL No: MFCD00156607
Molecular Formula: C7H9N3O2
Molecular Weight: 167.1653

Identification/Properties


Computed Properties
Molecular Weight:
167.168g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
1
Exact Mass:
167.069g/mol
Monoisotopic Mass:
167.069g/mol
Topological Polar Surface Area:
83.9A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
169
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


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