2,6-Pyridinedicarboxylic acid, 1,4-dihydro-4-oxo-, monohydrate


Chemical Name: 2,6-Pyridinedicarboxylic acid, 1,4-dihydro-4-oxo-, monohydrate
CAS Number: 199926-39-1
Product Number: AG002CGF(AGN-PC-0NIH30)
Synonyms:
MDL No:
Molecular Formula: C7H7NO6
Molecular Weight: 201.1336

Identification/Properties


Computed Properties
Molecular Weight:
201.134g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
2
Exact Mass:
201.027g/mol
Monoisotopic Mass:
201.027g/mol
Topological Polar Surface Area:
105A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
320
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:
2
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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