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CAS 2101206-53-3

:

1,1-Dimethylethyl 3,3-difluoro-4-[(4-fluorophenyl)methyl]-3,6-dihydro-1(2H)-pyridinecarboxylate

Description:
1,1-Dimethylethyl 3,3-difluoro-4-[(4-fluorophenyl)methyl]-3,6-dihydro-1(2H)-pyridinecarboxylate, identified by its CAS number 2101206-53-3, is a synthetic organic compound characterized by its complex structure, which includes a pyridine ring and multiple fluorine substituents. This compound typically exhibits properties associated with fluorinated organic molecules, such as increased lipophilicity and potential bioactivity due to the presence of the difluoromethyl and phenyl groups. The presence of the dimethyl group contributes to steric hindrance, which can influence its reactivity and interaction with biological targets. As a pyridine derivative, it may exhibit various pharmacological activities, making it of interest in medicinal chemistry. Additionally, the compound's stability and solubility can be affected by the fluorine atoms, which often enhance metabolic stability. Overall, this compound's unique structural features suggest potential applications in pharmaceuticals or agrochemicals, although specific biological activity and safety profiles would require further investigation.
Formula:C17H20F3NO2
InChI:InChI=1S/C17H20F3NO2/c1-16(2,3)23-15(22)21-9-8-13(17(19,20)11-21)10-12-4-6-14(18)7-5-12/h4-8H,9-11H2,1-3H3
InChI key:InChIKey=QXFGZSYLMKXYHE-UHFFFAOYSA-N
SMILES:C(C=1C(F)(F)CN(C(OC(C)(C)C)=O)CC1)C2=CC=C(F)C=C2
Synonyms:
  • 1(2H)-Pyridinecarboxylic acid, 3,3-difluoro-4-[(4-fluorophenyl)methyl]-3,6-dihydro-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 3,3-difluoro-4-[(4-fluorophenyl)methyl]-3,6-dihydro-1(2H)-pyridinecarboxylate
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