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

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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

  • 3-(1-{1-[({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)methyl]cyclopentyl}-N-(propan-2-yl)formamido)propanoic acid
  • 4-[(1,2,5-Thiadiazol-3-yl)methyl]oxolan-3-ol
  • 1-{[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4,4-dimethylpentanamido]methyl}cyclopropane-1-carboxylic acid
  • 2-[N-(butan-2-yl)-3-cyclopropyl-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanamido]acetic acid
  • 5-(2-methoxyethyl)-1-propyl-1H-1,2,3-triazole-4-carbaldehyde
  • 2-Amino-4-ethyl-1-propylcyclohexan-1-ol
  • 2-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-(methoxymethyl)propanamido]-2-methylbutanoic acid
  • 5-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-(methoxymethyl)butanamido]-2-methylpentanoic acid
  • {3-Oxo-2-oxa-7-thiaspiro[4.4]nonan-1-yl}methanesulfonyl chloride
  • 3-{2-[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanamido]phenyl}propanoic acid
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