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CAS 939757-95-6

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1-(1,1-Dimethylethyl) 4-(4-fluorophenyl)-1,3-pyrrolidinedicarboxylate

Description:
1-(1,1-Dimethylethyl) 4-(4-fluorophenyl)-1,3-pyrrolidinedicarboxylate, with CAS number 939757-95-6, is a chemical compound characterized by its pyrrolidine structure, which features two carboxylate groups and a tert-butyl substituent. This compound is typically classified as an ester due to the presence of the carboxylate functional groups. The presence of the 4-fluorophenyl group introduces a fluorine atom, which can influence the compound's reactivity and biological activity. The tert-butyl group contributes to steric hindrance, potentially affecting the compound's interactions with biological targets. This compound may exhibit properties such as lipophilicity, which can influence its solubility and permeability in biological systems. It is important to note that compounds with similar structures can exhibit diverse pharmacological activities, making this compound of interest in medicinal chemistry and drug development. Safety and handling precautions should be observed, as with all chemical substances, due to potential toxicity or reactivity.
Formula:C16H20FNO4
InChI:InChI=1S/C16H20FNO4/c1-16(2,3)22-15(21)18-8-12(13(9-18)14(19)20)10-4-6-11(17)7-5-10/h4-7,12-13H,8-9H2,1-3H3,(H,19,20)
InChI key:InChIKey=VRCJPGMBINFMCH-UHFFFAOYSA-N
SMILES:C(O)(=O)C1C(CN(C(OC(C)(C)C)=O)C1)C2=CC=C(F)C=C2
Synonyms:
  • 1-(1,1-Dimethylethyl) 4-(4-fluorophenyl)-1,3-pyrrolidinedicarboxylate
  • 1,3-Pyrrolidinedicarboxylic acid, 4-(4-fluorophenyl)-, 1-(1,1-dimethylethyl) ester
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