Butanoic acid, 2-fluoro-3-oxo-, ethyl ester


Chemical Name: Butanoic acid, 2-fluoro-3-oxo-, ethyl ester
CAS Number: 1522-41-4
Product Number: AG003Q44(AGN-PC-0JO8IZ)
Synonyms:
MDL No:
Molecular Formula: C6H9FO3
Molecular Weight: 148.1323

Identification/Properties


Properties
BP:
183 °C(lit.)
Storage:
Inert atmosphere;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.414(lit.)
Computed Properties
Molecular Weight:
148.133g/mol
XLogP3:
0.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
148.054g/mol
Monoisotopic Mass:
148.054g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
144
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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#:
N/A
Hazard Statements:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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