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Home > Nitro Compounds > 15128-91-3
15128-91-3 | 3-Pyridinol, 2,6-dinitro-
CAS No: 15128-91-3 Catalog No: AG001N8W MDL No:
Product Description
Catalog Number:
AG001N8W
Chemical Name:
3-Pyridinol, 2,6-dinitro-
CAS Number:
15128-91-3
Molecular Formula:
C5H3N3O5
Molecular Weight:
185.0944
IUPAC Name:
2,6-dinitropyridin-3-ol
InChI:
InChI=1S/C5H3N3O5/c9-3-1-2-4(7(10)11)6-5(3)8(12)13/h1-2,9H
InChI Key:
LFFZOHGXYHUOGO-UHFFFAOYSA-N
SMILES:
[O-][N+](=O)c1ccc(c(n1)[N+](=O)[O-])O
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
185.007g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
185.095g/mol
Monoisotopic Mass:
185.007g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
125A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4
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