ethyl 3-oxo-3-[4-(trifluoromethyl)phenyl]propanoate


Chemical Name: ethyl 3-oxo-3-[4-(trifluoromethyl)phenyl]propanoate
CAS Number: 106263-53-0
Product Number: AG003PZH(AGN-PC-0KKNU8)
Synonyms:
MDL No: MFCD03424818
Molecular Formula: C12H11F3O3
Molecular Weight: 260.2091

Identification/Properties


Properties
BP:
294.3°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Refractive Index:
n20/D 1.4880(lit.)
Computed Properties
Molecular Weight:
260.212g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
5
Exact Mass:
260.066g/mol
Monoisotopic Mass:
260.066g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
304
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#:
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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