Benzoic acid, 5-amino-2-nitro-, methyl ester


Chemical Name: Benzoic acid, 5-amino-2-nitro-, methyl ester
CAS Number: 35998-96-0
Product Number: AG003RX1(AGN-PC-009ACM)
Synonyms:
MDL No:
Molecular Formula: C8H8N2O4
Molecular Weight: 196.1601

Identification/Properties


Properties
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
196.162g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
196.048g/mol
Monoisotopic Mass:
196.048g/mol
Topological Polar Surface Area:
98.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
238
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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