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CAS 1186099-86-4

:

1,1-Dimethylethyl 7-fluoro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carboxylate

Description:
1,1-Dimethylethyl 7-fluoro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carboxylate, identified by its CAS number 1186099-86-4, is a chemical compound characterized by its complex structure, which includes a pyridoindole framework. This substance features a tert-butyl group (1,1-dimethylethyl) that contributes to its steric bulk, potentially influencing its reactivity and solubility. The presence of a fluorine atom at the 7-position of the pyrido ring may enhance its biological activity and lipophilicity, making it of interest in medicinal chemistry. The carboxylate functional group indicates potential for forming salts or participating in various chemical reactions. This compound may exhibit specific pharmacological properties, which could be explored in drug development contexts. Its synthesis and characterization would typically involve standard organic chemistry techniques, and its stability, solubility, and reactivity would be assessed through various analytical methods. Overall, this compound represents a unique structure that could have applications in pharmaceutical research or related fields.
Formula:C16H19FN2O2
InChI:InChI=1S/C16H19FN2O2/c1-16(2,3)21-15(20)19-7-6-13-12(9-19)11-5-4-10(17)8-14(11)18-13/h4-5,8,18H,6-7,9H2,1-3H3
InChI key:InChIKey=XDELENHQTKQTEU-UHFFFAOYSA-N
SMILES:C(OC(C)(C)C)(=O)N1CC=2C=3C(NC2CC1)=CC(F)=CC3
Synonyms:
  • 2H-Pyrido[4,3-b]indole-2-carboxylic acid, 7-fluoro-1,3,4,5-tetrahydro-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 7-fluoro-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indole-2-carboxylate
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