2,4-Pyridinedicarboxylicacid, hydrate (1:1)


Chemical Name: 2,4-Pyridinedicarboxylicacid, hydrate (1:1)
CAS Number: 207671-42-9
Product Number: AG002J7G(AGN-PC-00URZA)
Synonyms:
MDL No:
Molecular Formula: C7H7NO5
Molecular Weight: 185.1342

Identification/Properties


Properties
MP:
246-248 °C (dec.)(lit.)
Form:
Solid
Computed Properties
Molecular Weight:
185.135g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
185.032g/mol
Monoisotopic Mass:
185.032g/mol
Topological Polar Surface Area:
88.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
204
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


GHS Pictogram:
Signal Word:
Warning
UN#:
-
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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