3-(Trifluoromethyl)benzonitrile

ALDRICH/172901 - 99%

Synonym: α,α,α-Trifluoro-m-tolunitrile; 3-Cyanobenzotrifluoride

CAS Number: 368-77-4
Empirical Formula (Hill Notation): C₈H₄F₃N
Molecular Weight: 171.12
EC Number: 206-711-4
MDL Number: MFCD00001807
Linear Formula: CF₃C₆H₄CN
Product Type: Chemical

Catalog Number	PKG Qty.	Price	Quantity


45-172901-25G	25 g	$72.10 1/EA		Add To Favorites

Properties
Descriptions
Safety Info.
Basic Data

assay	99%
bp	189 °C (lit.)
density	1.281 g/mL at 25 °C (lit.)
form	liquid
functional group	fluoro
	nitrile
InChI	1S/C8H4F3N/c9-8(10,11)7-3-1-2-6(4-7)5-12/h1-4H
InChI key	OGOBINRVCUWLGN-UHFFFAOYSA-N
mp	16-20 °C (lit.)
Quality Level	100
refractive index	n20/D 1.4575 (lit.)
SMILES string	FC(F)(F)c1cccc(c1)C#N

Application:	3-(Trifluoromethyl)benzonitrile (α, α, α -trifluoro-m-tolunitrile) was used as a reference compound in the determination of the electron affinity of 1,3,5,7-cyclooctatetraene (COT).
Packaging:	25 g in glass bottle

Symbol	GHS07
Signal word	Warning
Hazard statements	H302 + H312 - H335
Precautionary statements	P261 - P264 - P270 - P280 - P301 + P312 - P302 + P352 + P312
RIDADR	NONH for all modes of transport
WGK Germany	WGK 3
Flash Point(F)	161.6 °F
Flash Point(C)	72 °C

Purity	99%
bp	189 °C (lit.)
mp	16-20 °C (lit.)
Density	1.281 g/mL at 25 °C (lit.)
Refractive Index	n20/D 1.4575 (lit.)
UNSPSC	12352100

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