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115044-40-1 | 3H-Imidazo[4,5-f]quinoxaline, 3,8-dimethyl-2-nitro-
CAS No: 115044-40-1 Catalog No: AG000FR7 MDL No:
Product Description
Catalog Number:
AG000FR7
Chemical Name:
3H-Imidazo[4,5-f]quinoxaline, 3,8-dimethyl-2-nitro-
CAS Number:
115044-40-1
Molecular Formula:
C11H9N5O2
Molecular Weight:
243.2215
IUPAC Name:
3,8-dimethyl-2-nitroimidazo[4,5-f]quinoxaline
InChI:
InChI=1S/C11H9N5O2/c1-6-5-12-7-3-4-8-10(9(7)13-6)14-11(15(8)2)16(17)18/h3-5H,1-2H3
InChI Key:
QJUZXQZNGRZGAG-UHFFFAOYSA-N
SMILES:
Cc1cnc2c(n1)c1nc(n(c1cc2)C)[N+](=O)[O-]
Properties
Complexity:
347
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.076g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
243.226g/mol
Monoisotopic Mass:
243.076g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
89.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5
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