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CAS 2094-73-7

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Ethyl 1-adamantanecarboxylate

Description:
Ethyl 1-adamantanecarboxylate, with the CAS number 2094-73-7, is an organic compound characterized by its adamantane structure, which is a polycyclic hydrocarbon known for its stability and unique three-dimensional shape. This compound features an ethyl ester functional group attached to the carboxylic acid derived from 1-adamantanecarboxylic acid. Ethyl 1-adamantanecarboxylate is typically a colorless to pale yellow liquid with a pleasant odor, and it is soluble in organic solvents while being less soluble in water due to its hydrophobic adamantane core. The compound is of interest in organic synthesis and medicinal chemistry, often serving as an intermediate in the preparation of various pharmaceuticals and biologically active compounds. Its stability and structural properties make it a valuable building block in the development of new materials and drugs. Additionally, it may exhibit interesting biological activities, although specific studies would be required to elucidate its pharmacological profile.
Formula:C13H20O2
InChI:InChI=1S/C13H20O2/c1-2-15-12(14)13-6-9-3-10(7-13)5-11(4-9)8-13/h9-11H,2-8H2,1H3
InChI key:InChIKey=SYEXGNJRYPOUSI-UHFFFAOYSA-N
SMILES:C(OCC)(=O)C12CC3CC(C1)CC(C2)C3
Synonyms:
  • 1-Adamantanecarboxylic acid, ethyl ester
  • 1-Adamantylcarboxylic acid ethyl ester
  • 1-Carbethoxyadamantane
  • Adamantane-1-carboxylic acid ethyl ester
  • Ethyl 1-adamantanecarboxylate
  • Ethyl Tricyclo[3.3.1.1~3,7~]Decane-1-Carboxylate
  • Tricyclo[3.3.1.1<sup>3,7</sup>]decane-1-carboxylic acid, ethyl ester
  • Tricyclo[3.3.1.13,7]decane-1-carboxylic acid, ethyl ester
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