1H-Benzimidazole, 5-nitro-, mononitrate


Chemical Name: 1H-Benzimidazole, 5-nitro-, mononitrate
CAS Number: 27896-84-0
Product Number: AG003MX3(AGN-PC-0O8JGZ)
Synonyms:
MDL No:
Molecular Formula: C7H6N4O5
Molecular Weight: 226.14634

Identification/Properties


Properties
MP:
220-222℃ (lit.)
Storage:
2-8℃;Inert atmosphere;
Form:
Solid
Computed Properties
Molecular Weight:
226.148g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
0
Exact Mass:
226.034g/mol
Monoisotopic Mass:
226.034g/mol
Topological Polar Surface Area:
141A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
216
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:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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