Benzeneacetic acid, 4-fluoro-a-oxo-, ethyl ester


Chemical Name: Benzeneacetic acid, 4-fluoro-a-oxo-, ethyl ester
CAS Number: 1813-94-1
Product Number: AG0022T9(AGN-PC-0QC0JG)
Synonyms:
MDL No:
Molecular Formula: C10H9FO3
Molecular Weight: 196.1751

Identification/Properties


Properties
BP:
117-118°C/7mm
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Refractive Index:
1.505
Computed Properties
Molecular Weight:
196.177g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
196.054g/mol
Monoisotopic Mass:
196.054g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
219
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-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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