4H-Pyran-4-one, 2-ethyl-3-hydroxy-


Chemical Name: 4H-Pyran-4-one, 2-ethyl-3-hydroxy-
CAS Number: 4940-11-8
Product Number: AG003H70(AGN-PC-0JKFNU)
Synonyms:
MDL No:
Molecular Formula: C7H8O3
Molecular Weight: 140.1366

Identification/Properties


Properties
MP:
85-95 °C(lit.);
BP:
290.3°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Refractive Index:
1.4850 (estimate)
Computed Properties
Molecular Weight:
140.138g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
140.047g/mol
Monoisotopic Mass:
140.047g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
213
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#:
-
Hazard Statements:
H302
Precautionary Statements:
P301+P312+P330
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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