CAS 159981-22-3

6-(2,2,2-Trifluoroethoxy)-3-pyridineacetonitrile

Description:

6-(2,2,2-Trifluoroethoxy)-3-pyridineacetonitrile, with the CAS number 159981-22-3, is a chemical compound characterized by its pyridine ring structure, which is a six-membered aromatic ring containing one nitrogen atom. This compound features a trifluoroethoxy group, which contributes to its unique properties, including increased lipophilicity and potential biological activity. The presence of the cyano group (acetonitrile) enhances its reactivity, making it useful in various synthetic applications. Typically, compounds like this may exhibit polar characteristics due to the electronegative fluorine atoms and the cyano group, influencing their solubility and interaction with biological systems. Additionally, the trifluoroethoxy moiety can impart stability and alter the compound's pharmacokinetic properties. Such compounds are often explored in medicinal chemistry for their potential therapeutic applications, particularly in the development of pharmaceuticals targeting specific biological pathways. As with many chemical substances, safety data sheets should be consulted for handling and toxicity information.

Formula: C₉H₇F₃N₂O

InChI: InChI=1S/C9H7F3N2O/c10-9(11,12)6-15-8-2-1-7(3-4-13)5-14-8/h1-2,5H,3,6H2

InChI key: InChIKey=ZRSZOBXUOPHVJM-UHFFFAOYSA-N

SMILES: O(CC(F)(F)F)C1=CC=C(CC#N)C=N1

Synonyms:

• 6-(2,2,2-Trifluoroethoxy)-3-pyridineacetonitrile
• 3-Pyridineacetonitrile, 6-(2,2,2-trifluoroethoxy)-
• 2-[6-(2,2,2-Trifluoroethoxy)pyridin-3-yl]acetonitrile

2-[6-(2,2,2-Trifluoroethoxy)pyridin-3-yl]acetonitrile

CAS: 159981-22-3

Versatile small molecule scaffold

Formula: C₉H₇F₃N₂O

Purity: Min. 95%

Molecular weight: 216.16 g/mol

Ref: 3D-JGA98122