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CAS 6553-80-6

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Cyclohexanecarboxylic acid, 1-methylethyl ester

Description:
Cyclohexanecarboxylic acid, 1-methylethyl ester, also known as isobutyl cyclohexanecarboxylate, is an organic compound characterized by its ester functional group derived from cyclohexanecarboxylic acid and isobutanol. This compound typically appears as a colorless to pale yellow liquid with a pleasant odor. It is relatively non-polar, making it soluble in organic solvents while having limited solubility in water. The presence of the cyclohexane ring contributes to its stability and influences its reactivity, while the ester group allows for participation in various chemical reactions, such as hydrolysis and transesterification. Cyclohexanecarboxylic acid, 1-methylethyl ester is often utilized in the synthesis of other organic compounds and may serve as a flavoring agent or fragrance in certain applications. Its physical properties, such as boiling point and density, are influenced by the molecular structure and the presence of the ester group. Safety data should be consulted for handling and storage, as with all chemical substances.
Formula:C10H18O2
InChI:InChI=1/C10H18O2/c1-8(2)12-10(11)9-6-4-3-5-7-9/h8-9H,3-7H2,1-2H3
InChI key:InChIKey=PMQZNGSMBAGPRU-UHFFFAOYSA-N
SMILES:C(OC(C)C)(=O)C1CCCCC1
Synonyms:
  • Cyclohexanecarboxylic acid isopropyl ester
  • Cyclohexanecarboxylic acid, 1-methylethyl ester
  • Isopropyl cyclohexanecarboxylate
  • Propan-2-Yl Cyclohexanecarboxylate
  • Ai3-19658
  • Einecs 229-474-9
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