Ethyl 4,4,4-Trifluorobutyrate

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Names

[ CAS No. ]:
371-26-6

[ Name ]:
Ethyl 4,4,4-Trifluorobutyrate

[Synonym ]:
ethyl 4,4,4-trifluorobutanoate
MFCD00041398
4,4,4-Trifluorobutyric Acid Ethyl Ester
Ethyl 4,4,4-trifluorobutyrate

Chemical & Physical Properties

[ Density]:
1.16 g/mL at 25 °C(lit.)

[ Boiling Point ]:
127 °C(lit.)

[ Molecular Formula ]:
C6H9F3O2

[ Molecular Weight ]:
170.13000

[ Flash Point ]:
92 °F

[ Exact Mass ]:
170.05500

[ PSA ]:
26.30000

[ LogP ]:
1.89200

[ Index of Refraction ]:
n20/D 1.3516(lit.)

[ Storage condition ]:
Flammables area

MSDS

Safety Information

[ Symbol ]:

GHS02, GHS07

[ Signal Word ]:
Warning

[ Hazard Statements ]:
H226-H302-H312-H319-H332-H335

[ Precautionary Statements ]:
P261-P280-P305 + P351 + P338

[ Personal Protective Equipment ]:
Eyeshields;Faceshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter

[ Hazard Codes ]:
Xn:Harmful;

[ Risk Phrases ]:
R10;R20/21/22;R36/37

[ Safety Phrases ]:
S16-S26-S36

[ RIDADR ]:
UN 3272 3/PG 3

[ WGK Germany ]:
3

[ Packaging Group ]:
III

[ Hazard Class ]:
3

[ HS Code ]:
2915900090

Precursor & DownStream

Precursor

  • Ethyl-(2E)-4,4,4-trifluorbut-2-enoat
  • 1,1,1-Trifluoro-3-iodopropane
  • Ethanol
  • carbon monoxide
  • 4,4,4-trifluoro-2-(triphenyl-λ5-phosphanylidene)butyric acid ethyl ester
  • fluoral
  • 3-acetoxy-4,4,4-trifluoro-but-2-enoic acid ethyl ester
  • Ethyl 3-hydroxy-4,4,4-trifluorobutyrate
  • ethyl 3-oxo-4,4,4-trifluorobutanoate enol
  • Ethyl chloroformate

DownStream

  • 4,4,4-Trifluorobutanal
  • 4,4,4-Trifluorobutanoic acid
  • 4,4,4-Trifluorobutanol
  • Ethyl 4,4,4-trifluoro-2-methylbutanoate
  • ETHYL 2,2-DIMETHYL-4,4,4-TRIFLUOROBUTYRATE
  • 4,4,4-Trifluorobutanoyl chloride

Customs

[ HS Code ]: 2915900090

[ Summary ]:
2915900090 other saturated acyclic monocarboxylic acids and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward) MFN tariff:5.5% General tariff:30.0%

Articles

Compounds Derived from 3-Halo-1, 1, 1-trifluoropropane1, 2. McBee E, et al.

J. Am. Chem. Soc. 72(11) , 5071-73, (1950)

J. Org. Chem. 60 , 5434, (1995)

Synthesis, structure-activity relationships, and pharmacological evaluation of a series of fluorinated 3-benzyl-5-indolecarboxamides: identification of 4-[[5-[((2R)-2-methyl-4,4,4-trifluorobutyl)carbamoyl]-1-methyl indol- 3-yl]methyl]-3-methoxy-N-[(2-methylphenyl)sulfonyl]benzamide, a potent, orally active antagonist of leukotrienes D4 and E4.

J. Med. Chem. 37 , 1282, (1994)

The continued exploration of a series of 3-(arylmethyl)-1H-indole-5-carboxamides by the introduction of fluorinated amide substituents has resulted in the discovery of 4-[[5-[((2R)-2-methyl-4,4,4-trif...


More Articles


Related Compounds

  • ethyl 3-methyl-4,4,4-trifluorobutyrate
  • Ethyl 2-methyl-4,4,4-trifluorobutyrate
  • Ethyl 2-methyl-3-hydroxy-4,4,4-trifluorobutyrate
  • ethyl 4,4,4-trifluoro-3-phenylbut-2-enoate
  • Ethyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)cyclohex-3-enecarboxylate
  • ethyl-[4-[4-[4-[ethyl(dimethyl)azaniumyl]but-2-ynoxy]phenoxy]but-2-ynyl]-dimethylazanium,diiodide
  • (6S,9R)-4-Fluoro-6,7,8,9-tetrahydro-5H-6,9-epiminocyclohepta[b]pyridine
  • N-[3-(aminomethyl)-2,4-dimethylphenyl]prop-2-enamide
  • 2-[3-(Ethylcarbamoyl)phenyl]-2-methylpropanoic acid
  • Limonin 7-(O-Carboxymethyl)oxime
  • 4-(Cyclopropoxymethyl)aniline
  • Imidazo[1,2-a]pyrazine-7(8H)-carboxylic acid, 2-formyl-5,6-dihydro-6-methyl-, 1,1-dimethylethyl ester
  • tert-Butyl (2-chloro-4-fluoro-6-(methylamino)phenyl)carbamate
  • 1,1-Dimethylethyl 3-(2-hydroxy-4-penten-1-yl)-1-azetidinecarboxylate
  • 5-Benzyl 2-(tert-butyl) 7-oxo-2,5,8-triazaspiro[3.5]nonane-2,5-dicarboxylate
  • tert-Butyl 2-formyl-6-(trifluoromethyl)-5,6-dihydroimidazo[1,2-a]pyrazine-7(8H)-carboxylate
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