3-Pyridinecarboxamide, 1-oxide


Chemical Name: 3-Pyridinecarboxamide, 1-oxide
CAS Number: 1986-81-8
Product Number: AG002BNH(AGN-PC-0JLAQA)
Synonyms:
MDL No:
Molecular Formula: C6H6N2O2
Molecular Weight: 138.1240

Identification/Properties


Properties
MP:
291-293˚C
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
138.126g/mol
XLogP3:
-1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
1
Exact Mass:
138.043g/mol
Monoisotopic Mass:
138.043g/mol
Topological Polar Surface Area:
68.6A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
138
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H302-H315-H320-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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