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

Modify Date: 2025-08-24 21:34:00

4,4,4-trifluoro-1-(4-fluorophenyl)-3-(trifluoromethyl)but-2-en-1-one structure	Common Name	4,4,4-trifluoro-1-(4-fluorophenyl)-3-(trifluoromethyl)but-2-en-1-one
	CAS Number	35444-02-1	Molecular Weight	286.14600
	Density	1.424g/cm3	Boiling Point	281.7ºC at 760 mmHg
	Molecular Formula	C₁₁H₅F₇O	Melting Point	N/A
	MSDS	N/A	Flash Point	107.8ºC

Name	4,4,4-trifluoro-1-(4-fluorophenyl)-3-(trifluoromethyl)but-2-en-1-one
Synonym	More Synonyms

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
InChIKey	PEXOKBNSWSJVAM-UHFFFAOYSA-N
SMILES	O=C(C=C(C(F)(F)F)C(F)(F)F)c1ccc(F)cc1

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

4,4,4-trifluoro...

CAS#:143211-32-9

~80%

4,4,4-trifluoro...

CAS#:35444-02-1

Literature: Burger, Klaus; Helmreich, Brigitte Journal fuer Praktische Chemie/Chemiker-Zeitung, 1992 , vol. 334, # 3 p. 219 - 226

1-(4-fluorophen...

CAS#:58518-77-7

4,4,4-trifluoro...

CAS#:35444-02-1

Literature: Burger, Klaus; Helmreich, Brigitte Journal fuer Praktische Chemie/Chemiker-Zeitung, 1992 , vol. 334, # 3 p. 219 - 226

4,4,4-trifluoro...

CAS#:143211-25-0

4,4,4-trifluoro...

CAS#:35444-02-1

Literature: Burger, Klaus; Helmreich, Brigitte Journal fuer Praktische Chemie/Chemiker-Zeitung, 1992 , vol. 334, # 3 p. 219 - 226

Precursor 1
CAS#:58518-77-7 1-(4-fluorophen...
DownStream 0

4'-Fluoro-4,4,4-trifluoro-3-trifluoromethylcrotonophenone

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Names

Chemical & Physical Properties

Toxicological Information

CHEMICAL IDENTIFICATION

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

Synthetic Route

Precursor & DownStream

Synonyms

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.