1(4H)-Pyridineacetic acid, 4-oxo-


Chemical Name: 1(4H)-Pyridineacetic acid, 4-oxo-
CAS Number: 45965-36-4
Product Number: AG00DD7L(AGN-PC-0JWI80)
Synonyms:
MDL No:
Molecular Formula: C7H7NO3
Molecular Weight: 153.1354

Identification/Properties


Computed Properties
Molecular Weight:
153.137g/mol
XLogP3:
-0.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
2
Exact Mass:
153.043g/mol
Monoisotopic Mass:
153.043g/mol
Topological Polar Surface Area:
57.6A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
226
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


NMR Spectrum


Other Analytical Data


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