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Home > Nitro Compounds > 18344-57-5
18344-57-5 | Pyridine, 3,5-dimethoxy-2-nitro-, 1-oxide
CAS No: 18344-57-5 Catalog No: AG0027LV MDL No:
Product Description
Catalog Number:
AG0027LV
Chemical Name:
Pyridine, 3,5-dimethoxy-2-nitro-, 1-oxide
CAS Number:
18344-57-5
Molecular Formula:
C7H8N2O5
Molecular Weight:
200.1488
IUPAC Name:
3,5-dimethoxy-2-nitro-1-oxidopyridin-1-ium
InChI:
InChI=1S/C7H8N2O5/c1-13-5-3-6(14-2)7(9(11)12)8(10)4-5/h3-4H,1-2H3
InChI Key:
AAFGLQVCQDGJHY-UHFFFAOYSA-N
SMILES:
COc1cc(OC)c[n+](c1[N+](=O)[O-])[O-]
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.043g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
200.15g/mol
Monoisotopic Mass:
200.043g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
89.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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