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CS-W001157 4
Total: USD 88.00

4-Ethylcyclohexanecarboxylic acid

  • CAS No. 91328-77-7

  • Cat. No. CS-W018003
  • Purity≥98%
  • MDL No.MFCD01568857

*For research and further manufacturing use only, not for direct human use.

4-Ethylcyclohexanecarboxylic acid|CS-W018003

Structure of 91328-77-7

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General Information

  • CAS No. 91328-77-7
  • Cat. No. CS-W018003
  • Purity ≥98%
  • MDL No. MFCD01568857
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₆O₂
  • Molecular Weight 156.23
  • Synonym(s) None
  • SMILES O=C(C1CCC(CC)CC1)O

Description

4-Ethylcyclohexanecarboxylic acid features a rigid cyclohexane ring with a carboxylic acid group at the para position relative to an ethyl substituent. This configuration imparts enhanced hydrophobic character and conformational stability, making it valuable for designing bioactive molecules and functional materials requiring defined spatial orientation and lipophilicity.

Application

4-Ethylcyclohexanecarboxylic acid serves as a versatile building block in medicinal chemistry and organic synthesis, offering a rigid, lipophilic cyclohexane scaffold with a pendant carboxylic acid for derivatization. Its bench-stable nature and compatibility with standard coupling reactions enable efficient access to diverse analogs. The ethyl substituent enhances metabolic stability and modulates partitioning properties, making it valuable in the construction of bioactive molecules and API intermediates.

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.2874
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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