structure of 2-(2-Chloro-6-methylpyridin-3-yl)acetonitrile

2-(2-Chloro-6-methylpyridin-3-yl)acetonitrile

CAS No.: 1000514-91-9
M. Wt: 166.61
M. Fa: C8H7ClN2
InChI Key: QRYFRROYXPUUEZ-UHFFFAOYSA-N

Names and Identifiers of 1000514-91-9

CAS Number

1000514-91-9

IUPAC Name

2-(2-chloro-6-methylpyridin-3-yl)acetonitrile

InChI

InChI=1S/C8H7ClN2/c1-6-2-3-7(4-5-10)8(9)11-6/h2-3H,4H2,1H3

InChIKey

QRYFRROYXPUUEZ-UHFFFAOYSA-N

Canonical SMILES

CC1=NC(=C(C=C1)CC#N)Cl

Physical and chemical properties of 1000514-91-9

Acidity coefficient

0.54±0.10(Predicted)

Boiling Point

297.8±35.0 °C(Predicted)

Density

1?+-.0.06 g/cm3(Predicted)

Molecular Formula

C8H7ClN2

Molecular Weight

166.61

Safety Information of 1000514-91-9

Pictograms

Signal Word

Warning

Safety Data Sheet

Supports customized editing of SDS information and downloading in PDF documents.

Applications of 1000514-91-9

This compound finds applications in various fields:

  • Pharmaceuticals: As a building block for synthesizing drugs targeting neurological disorders and inflammation.
  • Organic Synthesis: Employed as an intermediate in the synthesis of more complex organic compounds.
  • Material Science: Potential use in developing new materials due to its unique electronic properties.

Interaction Studies of 1000514-91-9

Studies have shown that 2-(2-Chloro-6-methylpyridin-3-yl)acetonitrile interacts with several biological targets, particularly within the central nervous system. Its structural features allow it to modulate receptor activity, which is crucial for developing therapeutic agents aimed at cognitive impairments and other neurological conditions.

Biological Activity of 1000514-91-9

Research indicates that compounds similar to 2-(2-Chloro-6-methylpyridin-3-yl)acetonitrile exhibit significant biological activities, including potential anti-inflammatory and anticancer properties. The presence of the pyridine moiety is often associated with interactions at various biological targets, such as receptors involved in neurotransmission and inflammation.