1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-amino-5-nitro-


Chemical Name: 1H-Benz[de]isoquinoline-1,3(2H)-dione, 2-amino-5-nitro-
CAS Number: 62578-85-2
Product Number: AG00ENAY(AGN-PC-0K6NRI)
Synonyms:
MDL No:
Molecular Formula: C12H7N3O4
Molecular Weight: 257.2017

Identification/Properties


Computed Properties
Molecular Weight:
257.205g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
0
Exact Mass:
257.044g/mol
Monoisotopic Mass:
257.044g/mol
Topological Polar Surface Area:
109A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
447
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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