CAS 927209-99-2

1,1-Dimethylethyl 4-fluorocyclohexanecarboxylate

Description:

1,1-Dimethylethyl 4-fluorocyclohexanecarboxylate, with the CAS number 927209-99-2, is an organic compound characterized by its ester functional group and a cyclohexane ring. This compound features a tert-butyl group (1,1-dimethylethyl) attached to a carboxylate moiety, which contributes to its reactivity and solubility properties. The presence of a fluorine atom at the 4-position of the cyclohexane ring can influence the compound's polarity and biological activity, potentially enhancing its lipophilicity and altering its interaction with biological systems. Typically, such compounds may exhibit interesting properties in terms of their stability, reactivity, and potential applications in pharmaceuticals or agrochemicals. The molecular structure suggests that it may participate in various chemical reactions, including nucleophilic substitutions or esterification processes. As with many organic compounds, safety data and handling precautions should be considered, particularly regarding its potential toxicity and environmental impact.

Formula: C₁₁H₁₉FO₂

InChI: InChI=1S/C11H19FO2/c1-11(2,3)14-10(13)8-4-6-9(12)7-5-8/h8-9H,4-7H2,1-3H3

InChI key: InChIKey=NVXUUGMXLMMJBK-UHFFFAOYSA-N

SMILES: C(OC(C)(C)C)(=O)C1CCC(F)CC1

Synonyms:

• 1,1-Dimethylethyl 4-fluorocyclohexanecarboxylate
• tert-Butyl 4-fluorocyclohexanecarboxylate
• Cyclohexanecarboxylic acid, 4-fluoro-, 1,1-dimethylethyl ester