4-(Trifluoromethoxy)phenylacetonitrile, 98%

Name: 4-(Trifluoromethoxy)phenylacetonitrile, 98%
Brand: Vaqora Chemicals
SKU: VQ-009652

About 4-(Trifluoromethoxy)phenylacetonitrile, 98%

Listed under CAS 49561-96-8, 4-(Trifluoromethoxy)phenylacetonitrile is a nitrile building block available from Vaqora Chemicals at a purity of 98%. Formula C9H6F3NO, molecular weight 201.14 g/mol. Systematically, it is named 2-[4-(trifluoromethoxy)phenyl]acetonitrile. It is also known as p-Trifluoromethoxyphenyl acetonitrile or 2-(4-(Trifluoromethoxy)phenyl)acetonitrile.

The material typically appears as a colourless to light yellow to yellow solid or liquid. Literature values give a melting point of 30-33 °C. Keep containers tightly closed in a cool, well-ventilated area away from heat and ignition sources. The GHS classification uses the signal word “Danger”, so appropriate gloves, eye protection and ventilation are recommended.

It is commonly used for organic synthesis and API synthesis. Typical end-use sectors are pharmaceutical manufacturing and academic and industrial research.

Available in 1 g, 5 g and 25 g packs, 4-(Trifluoromethoxy)phenylacetonitrile is dispatched with a Certificate of Analysis (COA) to destinations worldwide.

Typical applications

Organic synthesis
API synthesis

Industries

Specifications & identifiers

Chemical identifiers
Product name	4-(Trifluoromethoxy)phenylacetonitrile, 98%
Catalogue No.	VQ-009652
CAS Number	49561-96-8
IUPAC name	2-[4-(trifluoromethoxy)phenyl]acetonitrile
Molecular formula	C₉H₆F₃NO
Molecular weight	201.14 g/mol
Exact mass	201.0401
Purity / assay	98%
HSN code	29420090
InChIKey	LYFCAROXYJTUQF-UHFFFAOYSA-N
SMILES	C1=CC(=CC=C1CC#N)OC(F)(F)F
PubChem CID	142676

Physical properties
Physical form	Liquid
Appearance	Colourless to light yellow to yellow solid or liquid
Melting point	30-33 °C
LogP (XLogP3)	3
H-bond donors / acceptors	0 / 5
TPSA	33 Å²
Synonyms	p-Trifluoromethoxyphenyl acetonitrile, 2-(4-(Trifluoromethoxy)phenyl)acetonitrile, 4-(Trifluoromethoxy)benzyl cyanide, 4-trifluoromethoxybenzylcyanide, 4-trifluoromethoxyphenylacetonitrile, 2-[4-(trifluoromethoxy)phenyl]ethanenitrile, Benzeneacetonitrile, 4-(trifluoromethoxy)-, [4-(trifluoromethoxy)phenyl]acetonitrile, 4-trifluorometho, (4-trifluoromethoxy-phenyl)-acetonitrile, 4-trifluoromethoxy-phenylacetonitrile, (4-trifluoromethoxyphenyl)acetonitrile

Safety & hazard information (GHS)

Toxic

Harmful / irritant

Signal word: Danger

Hazard statements

H301Toxic if swallowed
H302Harmful if swallowed
H312Harmful in contact with skin
H315Causes skin irritation
H319Causes serious eye irritation
H332Harmful if inhaled

Precautionary statements: P261, P264, P264 + P265, P270, P271, P280, P301 + P316, P301 + P317, P302 + P352, P304 + P340, P305 + P351 + P338, P317, P321, P330, P332 + P317, P337 + P317, P362 + P364, P405, P501

Classification is indicative (aggregated GHS notifications) and may vary by grade and concentration. Always refer to the SDS supplied with your lot.

Documents

Safety Data Sheet (SDS)16-section GHS · on request Certificate of AnalysisTypical / batch COA · on request Specification sheetTDS / MOA · on request

Frequently asked questions

What is the CAS number of 4-(Trifluoromethoxy)phenylacetonitrile, 98%?

The CAS Registry Number of 4-(Trifluoromethoxy)phenylacetonitrile, 98% is 49561-96-8. It is also known as p-Trifluoromethoxyphenyl acetonitrile, 2-(4-(Trifluoromethoxy)phenyl)acetonitrile, 4-(Trifluoromethoxy)benzyl cyanide.

What is the molecular formula and molecular weight of 4-(Trifluoromethoxy)phenylacetonitrile, 98%?

4-(Trifluoromethoxy)phenylacetonitrile, 98% has the molecular formula C9H6F3NO and a molecular weight of 201.14 g/mol. Its IUPAC name is 2-[4-(trifluoromethoxy)phenyl]acetonitrile.

Which grade and pack sizes of 4-(Trifluoromethoxy)phenylacetonitrile, 98% can I order?

We supply 4-(Trifluoromethoxy)phenylacetonitrile, 98% in (98%) grade, in 1 g, 5 g, 25 g packs. Larger bulk quantities and custom packing are quoted on request.

Do you provide a COA and SDS with 4-(Trifluoromethoxy)phenylacetonitrile, 98%?

Yes. Every lot of 4-(Trifluoromethoxy)phenylacetonitrile, 98% is shipped with a batch-specific Certificate of Analysis, and a 16-section GHS Safety Data Sheet is provided with the quotation and the shipment.

Can 4-(Trifluoromethoxy)phenylacetonitrile, 98% be shipped internationally?

Yes. 4-(Trifluoromethoxy)phenylacetonitrile, 98% is classified as hazardous, so it is packed in UN-approved packaging and shipped as dangerous goods under IATA/IMDG rules. We export worldwide on EXW, FOB, CIF and DAP terms.