6-imidazol-1-yl-7-nitro-1,4-dihydroquinoxaline-2,3-dione;hydrochloride


Chemical Name: 6-imidazol-1-yl-7-nitro-1,4-dihydroquinoxaline-2,3-dione;hydrochloride
CAS Number: 154164-30-4
Product Number: AG00AKR0(AGN-PC-0LQYOP)
Synonyms:
MDL No:
Molecular Formula: C11H8ClN5O4
Molecular Weight: 309.6653

Identification/Properties


Computed Properties
Molecular Weight:
309.666g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
1
Exact Mass:
309.026g/mol
Monoisotopic Mass:
309.026g/mol
Topological Polar Surface Area:
122A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
451
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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