2-Pyridinecarboxylic acid, 1,6-dihydro-6-oxo-1-(phenylmethoxy)-


Chemical Name: 2-Pyridinecarboxylic acid, 1,6-dihydro-6-oxo-1-(phenylmethoxy)-
CAS Number: 210366-15-7
Product Number: AG002KQD(AGN-PC-00P9RE)
Synonyms:
MDL No:
Molecular Formula: C13H11NO4
Molecular Weight: 245.2307

Identification/Properties


Computed Properties
Molecular Weight:
245.234g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
245.069g/mol
Monoisotopic Mass:
245.069g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
394
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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