Butanoic acid, 2-(ethoxymethylene)-3-oxo-, ethyl ester


Chemical Name: Butanoic acid, 2-(ethoxymethylene)-3-oxo-, ethyl ester
CAS Number: 3788-94-1
Product Number: AG0037A0(AGN-PC-0JM2O3)
Synonyms:
MDL No:
Molecular Formula: C9H14O4
Molecular Weight: 186.2051

Identification/Properties


Properties
BP:
268.8°C at 760 mmHg
Storage:
Keep in dry area;-10 ℃;
Form:
Liquid
Refractive Index:
1.4730 to 1.4770
Computed Properties
Molecular Weight:
186.207g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
6
Exact Mass:
186.089g/mol
Monoisotopic Mass:
186.089g/mol
Topological Polar Surface Area:
52.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
218
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
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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