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CAS 1638761-15-5

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1-(1,1-Dimethylethyl) 5-(trifluoromethyl)-1,3-piperidinedicarboxylate

Description:
1-(1,1-Dimethylethyl) 5-(trifluoromethyl)-1,3-piperidinedicarboxylate is a chemical compound characterized by its piperidine structure, which includes a piperidine ring substituted with both a tert-butyl group and a trifluoromethyl group. This compound features two carboxylate ester functionalities, contributing to its potential reactivity and solubility properties. The presence of the trifluoromethyl group enhances lipophilicity and may influence biological activity, making it of interest in medicinal chemistry. The tert-butyl group provides steric hindrance, which can affect the compound's interaction with biological targets. This compound is likely to be a solid at room temperature and may exhibit moderate stability under standard conditions. Its unique structure suggests potential applications in pharmaceuticals or agrochemicals, although specific biological activities or applications would require further investigation. Safety data and handling precautions should be consulted due to the presence of fluorinated groups, which can pose environmental and health risks.
Formula:C12H18F3NO4
InChI:InChI=1S/C12H18F3NO4/c1-11(2,3)20-10(19)16-5-7(9(17)18)4-8(6-16)12(13,14)15/h7-8H,4-6H2,1-3H3,(H,17,18)
InChI key:InChIKey=NGBSMBNZYWUQCC-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1CC(C(F)(F)F)CC(C(O)=O)C1
Synonyms:
  • 1-(1,1-Dimethylethyl) 5-(trifluoromethyl)-1,3-piperidinedicarboxylate
  • 1,3-Piperidinedicarboxylic acid, 5-(trifluoromethyl)-, 1-(1,1-dimethylethyl) ester
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