2H-Pyran-3,5(4H,6H)-dione


Chemical Name: 2H-Pyran-3,5(4H,6H)-dione
CAS Number: 61363-56-2
Product Number: AG0036Z5(AGN-PC-0JM436)
Synonyms:
MDL No:
Molecular Formula: C5H6O3
Molecular Weight: 114.0993

Identification/Properties


Properties
MP:
128-129℃(Solv: ethyl acetate (141-78-6))
BP:
275.1°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;Light sensitive;
Form:
Solid
Computed Properties
Molecular Weight:
114.1g/mol
XLogP3:
-0.3
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
0
Exact Mass:
114.032g/mol
Monoisotopic Mass:
114.032g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
8
Formal Charge:
0
Complexity:
114
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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