4,4,4-trifluoro-1-(4-fluorophenyl)-3-(trifluoromethyl)but-2-en-1-one

Suppliers

Names

[ CAS No. ]:
35444-02-1

[ Name ]:
4,4,4-trifluoro-1-(4-fluorophenyl)-3-(trifluoromethyl)but-2-en-1-one

[Synonym ]:
4'-Fluoro-4,4,4-trifluoro-3-trifluoromethylcrotonophenone

Chemical & Physical Properties

[ Density]:
1.424g/cm3

[ Boiling Point ]:
281.7ºC at 760 mmHg

[ Molecular Formula ]:
C11H5F7O

[ Molecular Weight ]:
286.14600

[ Flash Point ]:
107.8ºC

[ Exact Mass ]:
286.02300

[ PSA ]:
17.07000

[ LogP ]:
4.05940

[ Index of Refraction ]:
1.421

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
GQ6550000
CHEMICAL NAME :
Crotonophenone, 4'-fluoro-4,4,4-trifluoro-3-(trifluoromethyl)-
CAS REGISTRY NUMBER :
35444-02-1
LAST UPDATED :
199612
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C11-H5-F7-O
MOLECULAR WEIGHT :
286.16
WISWESSER LINE NOTATION :
FXFFYU1VR DF&XFFF

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
56 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
CSLNX* U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. (Aberdeen Proving Ground, MD 21010) Volume(issue)/page/year: NX#08667

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 1-(4-fluorophenyl)ethenoxy-trimethylsilane

DownStream

Related Compounds

  • tert-butyl 7-bromo-3,3,4-trimethyl-2,3-dihydro-1H-indole-1-carboxylate
  • tert-butyl N-[(4-bromophenyl)(cyclobutyl)methyl]carbamate
  • Tert-butyl 3-[(4-bromophenyl)methyl]-3-methylazetidine-1-carboxylate
  • (2S)-2-benzenesulfonamido-3-(2,2,2-trifluoroacetamido)propanoic acid
  • benzyl N-(3-nitro-2-oxo-2H-chromen-4-yl)carbamate
  • benzyl N-[5-(4-nitrophenyl)-1,3,4-oxadiazol-2-yl]carbamate
  • tert-butyl N-[4-sulfamoyl-3-(trifluoromethyl)phenyl]carbamate
  • tert-butyl N-[5-(2-fluoro-4-nitrophenyl)-1,3,4-thiadiazol-2-yl]carbamate
  • 2-{[(Tert-butoxy)carbonyl](2-methoxyethyl)amino}-5-nitrobenzoic acid
  • Ethyl 4-{[(benzyloxy)carbonyl]amino}-5-cyano-2-hydroxybenzoate
The content on this webpage is sourced from various professional data sources. If you have any questions or concerns regarding the content, please feel free to contact service1@chemsrc.com.