Aniline, 2,3-dinitro-


Chemical Name: Aniline, 2,3-dinitro-
CAS Number: 602-03-9
Product Number: AG00EB1I(AGN-PC-0JMOU8)
Synonyms:
MDL No:
Molecular Formula: C6H5N3O4
Molecular Weight: 183.1216

Identification/Properties


Computed Properties
Molecular Weight:
183.123g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
183.028g/mol
Monoisotopic Mass:
183.028g/mol
Topological Polar Surface Area:
118A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
221
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

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NMR Spectrum


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