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CAS 470482-40-7

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1,1-Dimethylethyl (2S,4S)-2-(hydroxymethyl)-4-(trifluoromethyl)-1-pyrrolidinecarboxylate

Description:
1,1-Dimethylethyl (2S,4S)-2-(hydroxymethyl)-4-(trifluoromethyl)-1-pyrrolidinecarboxylate, with the CAS number 470482-40-7, is a chemical compound characterized by its pyrrolidine structure, which includes a carboxylate functional group. This compound features a trifluoromethyl group, which significantly influences its chemical properties, including increased lipophilicity and potential reactivity. The presence of a hydroxymethyl group adds to its functional diversity, potentially allowing for hydrogen bonding interactions. The stereochemistry indicated by (2S,4S) suggests specific spatial arrangements of the substituents around the pyrrolidine ring, which can affect the compound's biological activity and reactivity. Generally, compounds with such structures may exhibit interesting pharmacological properties, making them of interest in medicinal chemistry. Additionally, the presence of the tert-butyl group (1,1-dimethylethyl) can enhance the stability and solubility of the compound in organic solvents. Overall, this compound's unique combination of functional groups and stereochemistry contributes to its potential applications in various chemical and pharmaceutical contexts.
Formula:C11H18F3NO3
InChI:InChI=1S/C11H18F3NO3/c1-10(2,3)18-9(17)15-5-7(11(12,13)14)4-8(15)6-16/h7-8,16H,4-6H2,1-3H3/t7-,8-/m0/s1
InChI key:InChIKey=CRSWFECHMDRHHV-YUMQZZPRSA-N
SMILES:C(OC(C)(C)C)(=O)N1[C@H](CO)C[C@H]([C@@](F)(F)F)C1
Synonyms:
  • 1,1-Dimethylethyl (2S,4S)-2-(hydroxymethyl)-4-(trifluoromethyl)-1-pyrrolidinecarboxylate
  • 1-Pyrrolidinecarboxylic acid, 2-(hydroxymethyl)-4-(trifluoromethyl)-, 1,1-dimethylethyl ester, (2S,4S)-
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