2-(3-TRIFLUOROBENZYLIDENE)-MALONONITRILE

Modify Date: 2025-08-25 19:57:03

2-(3-TRIFLUOROBENZYLIDENE)-MALONONITRILE structure	Common Name	2-(3-TRIFLUOROBENZYLIDENE)-MALONONITRILE
	CAS Number	36937-90-3	Molecular Weight	222.16600
	Density	1.33g/cm3	Boiling Point	302ºC at 760mmHg
	Molecular Formula	C₁₁H₅F₃N₂	Melting Point	N/A
	MSDS	N/A	Flash Point	136.5ºC

Name	2-[[3-(trifluoromethyl)phenyl]methylidene]propanedinitrile

Density	1.33g/cm3
Boiling Point	302ºC at 760mmHg
Molecular Formula	C₁₁H₅F₃N₂
Molecular Weight	222.16600
Flash Point	136.5ºC
Exact Mass	222.04000
PSA	47.58000
LogP	3.13596
Index of Refraction	1.528

CHEMICAL IDENTIFICATION

RTECS NUMBER :: OO4480000

CHEMICAL NAME :: Malononitrile, (3-trifluoromethylbenzylidene)-

CAS REGISTRY NUMBER :: 36937-90-3

LAST UPDATED :: 199612

DATA ITEMS CITED :: 1

MOLECULAR FORMULA :: C11-H5-F3-N2

MOLECULAR WEIGHT :: 222.18

WISWESSER LINE NOTATION :: NCYCN&U1R CXFFF

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#07631

Hazard Codes	Xi: Irritant;
HS Code	2926909090

3-(Trifluoromet...

CAS#:454-89-7

Malononitrile

CAS#:109-77-3

2-(3-TRIFLUOROB...

CAS#:36937-90-3

Literature: Chang, Lisa C. W.; Von Frijtag Drabbe Kuenzel, Jacobien K.; Mulder-Krieger, Thea; Spanjersberg, Ronald F.; Roerink, Sophie F.; Van Den Hout, Gijs; Beukers, Margot W.; Brussee, Johannes; Ijzerman, Adriaan P. Journal of Medicinal Chemistry, 2005 , vol. 48, # 6 p. 2045 - 2053

HS Code	2926909090
Summary	HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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Product Name: 2-(3-TRIFLUOROBENZYLIDENE)-MALONONITRILE
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