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66108-86-9

66108-86-9 structural image
Product Name: N1-BENZYL-4-NITRO-1,2-BENZENEDIAMINE
Formula: C13H13N3O2
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COMPUTED DESCRIPTORS

Molecular Weight 243.26 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 243.100776666 g/mol
Monoisotopic Mass 243.100776666 g/mol
Topological Polar Surface Area 83.9 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 274
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