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66695-19-0 | 2-Methyl-6-(3-pyridylcarbamoyl)pyridine 1-oxide
CAS No: 66695-19-0 Catalog No: AG00FXT9 MDL No:
Product Description
Catalog Number:
AG00FXT9
Chemical Name:
2-Methyl-6-(3-pyridylcarbamoyl)pyridine 1-oxide
CAS Number:
66695-19-0
IUPAC Name:
6-methyl-1-oxido-N-pyridin-3-ylpyridin-1-ium-2-carboxamide
InChI:
InChI=1S/C12H11N3O2/c1-9-4-2-6-11(15(9)17)12(16)14-10-5-3-7-13-8-10/h2-8H,1H3,(H,14,16)
InChI Key:
DGXSIMTVHVJMTF-UHFFFAOYSA-N
Properties
Complexity:
273
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.085g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
229.239g/mol
Monoisotopic Mass:
229.085g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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