CAS 1803610-05-0

5-(1,1-Dimethylethyl)-2-thiazoleacetonitrile

Description:

5-(1,1-Dimethylethyl)-2-thiazoleacetonitrile is a chemical compound characterized by its thiazole ring and acetonitrile functional group. The thiazole moiety contributes to its potential biological activity, often associated with compounds that exhibit antimicrobial or antifungal properties. The presence of the tert-butyl group (1,1-dimethylethyl) enhances the lipophilicity of the molecule, which can influence its solubility and permeability in biological systems. This compound is typically synthesized through organic reactions involving thiazole derivatives and acetonitrile. Its structure suggests that it may participate in various chemical reactions, including nucleophilic substitutions and electrophilic additions. The compound's CAS number, 1803610-05-0, allows for its identification in chemical databases, facilitating research and development in fields such as pharmaceuticals and agrochemicals. Safety and handling precautions should be observed, as with any chemical substance, to mitigate potential hazards associated with its use.

Formula: C₉H₁₂N₂S

InChI: InChI=1S/C9H12N2S/c1-9(2,3)7-6-11-8(12-7)4-5-10/h6H,4H2,1-3H3

InChI key: InChIKey=LRIRHKNGJZWWLC-UHFFFAOYSA-N

SMILES: C(C)(C)(C)C=1SC(CC#N)=NC1

Synonyms:

• 2-Thiazoleacetonitrile, 5-(1,1-dimethylethyl)-
• 5-(1,1-Dimethylethyl)-2-thiazoleacetonitrile

2-(5-tert-Butyl-1,3-thiazol-2-yl)acetonitrile

CAS: 1803610-05-0

Versatile small molecule scaffold

Formula: C₉H₁₂N₂S

Purity: Min. 95%

Molecular weight: 180.27 g/mol

Ref: 3D-DXC61005