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Home > Nitro Compounds > 51595-55-2
51595-55-2 | 4,4'-Dinitro-[2,2'-bipyridine] 1,1'-dioxide
CAS No: 51595-55-2 Catalog No: AG006UT4 MDL No:MFCD00065175
Product Description
Catalog Number:
AG006UT4
Chemical Name:
4,4'-Dinitro-[2,2'-bipyridine] 1,1'-dioxide
CAS Number:
51595-55-2
Molecular Formula:
C10H6N4O6
Molecular Weight:
278.1778
MDL Number:
MFCD00065175
IUPAC Name:
4-nitro-2-(4-nitro-1-oxidopyridin-2-ylidene)pyridin-1-ium 1-oxide
InChI:
InChI=1S/C10H6N4O6/c15-11-3-1-7(13(17)18)5-9(11)10-6-8(14(19)20)2-4-12(10)16/h1-6H
InChI Key:
QVRTYCMSRZUOJO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1cc[n+](c(c1)c1cc(cc[n+]1[O-])[N+](=O)[O-])[O-]
Properties
Complexity:
603
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.029g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
278.18g/mol
Monoisotopic Mass:
278.029g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
-0.2
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