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Home > Nitro Compounds > 84175-12-2
84175-12-2 | 4,4'-DINITRO-2,2'-BIPYRIDINE N-OXIDE
CAS No: 84175-12-2 Catalog No: AG004P46 MDL No:
Product Description
Catalog Number:
AG004P46
Chemical Name:
4,4'-DINITRO-2,2'-BIPYRIDINE N-OXIDE
CAS Number:
84175-12-2
Molecular Formula:
C10H6N4O5
Molecular Weight:
262.1784
IUPAC Name:
4-nitro-2-(4-nitropyridin-2-yl)-1-oxidopyridin-1-ium
InChI:
InChI=1S/C10H6N4O5/c15-12-4-2-8(14(18)19)6-10(12)9-5-7(13(16)17)1-3-11-9/h1-6H
InChI Key:
URJOIZFTDVMRNQ-UHFFFAOYSA-N
SMILES:
[O-][n+]1ccc(cc1c1nccc(c1)[N+](=O)[O-])[N+](=O)[O-]
Properties
Complexity:
355
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.034g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.181g/mol
Monoisotopic Mass:
262.034g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
130A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
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