Ethyl 2,4,5-trifluoro-β-oxobenzenepropanoate
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Ethyl 2,4,5-trifluoro-β-oxobenzenepropanoate
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CAS No:
98349-24-7
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Formula:
C11H9F3O3
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Chemical Name:
Ethyl 2,4,5-trifluoro-β-oxobenzenepropanoate
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Synonyms:
Benzenepropanoic acid,2,4,5-trifluoro-β-oxo-,ethyl ester;Ethyl 2,4,5-trifluoro-β-oxobenzenepropanoate;Ethyl 2,4,5-trifluorobenzoylacetate;3-Oxo-3-(2,4,5-trifluorophenyl)propionic acid ethyl ester;2,4,5-trifluoro-β-oxobenzenepropanoic acid ethyl ester;Ethyl 2,4,5-Trifluoro-β-oxobenzenepropanoate;Ethyl 3-oxo-3-(2,4,5-trifluorophenyl)propanoate
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CAS No:
Ethyl 2,4,5-trifluoro-β-oxobenzenepropanoate Basic Attributes
246.18
246.18
DTXSID60374557
2916399090
Characteristics
43.37000
2.23980
White solid
1.319±0.06 g/cm3
66-68°C
92 °C @ Press: 0.08 Torr
121.2ºC
1.468
10.26±0.50
Safety Information
IRRITANT
UN2811 6.1
36/37/38
26-36/37/39
C,Xi,T
|Danger|H302 (50%): Harmful if swallowed [Warning Acute toxicity, oral]|P260, P261, P264, P270, P271, P280, P301+P312, P301+P330+P331, P302+P352, P303+P361+P353, P304+P312, P304+P340, P305+P351+P338, P310, P312, P321, P322, P330, P363, P405, and P501|Aggregated GHS information provided by 2 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Computed Properties
Molecular Weight:246.18
XLogP3:2.3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:5
Exact Mass:246.05037863
Monoisotopic Mass:246.05037863
Topological Polar Surface Area:43.4
Heavy Atom Count:17
Complexity:296
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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