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CS-W001157 4
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Ethyl 2-hydroxycyclohexanecarboxylate

  • CAS No. 3444-72-2

  • Cat. No. CS-W005922
  • Purity≥97%
  • MDL No.MFCD00832060

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

Ethyl 2-hydroxycyclohexanecarboxylate|CS-W005922

Structure of 3444-72-2

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General Information

  • CAS No. 3444-72-2
  • Cat. No. CS-W005922
  • Purity ≥97%
  • MDL No. MFCD00832060
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₆O₃
  • Molecular Weight None
  • Synonym(s) cyclohexanecarboxylic acid, 2-hydroxy-, ethyl ester
  • SMILES O=C(C1C(O)CCCC1)OCC

Description

Ethyl 2-hydroxycyclohexanecarboxylate features a cyclohexane ring bearing both hydroxyl and ester functionalities, enabling selective derivatization at the secondary alcohol site. This configuration supports stereocontrolled synthesis in natural product chemistry and offers enhanced solubility in polar organic solvents compared to non-hydroxylated analogs.

Application

Ethyl 2-hydroxycyclohexanecarboxylate serves as a versatile building block in synthetic organic chemistry, enabling efficient access to functionalized cyclohexane scaffolds. The pendant hydroxyl group facilitates selective derivatization, while the ester functionality supports broad transformations including reduction, oxidation, and coupling reactions. Its bench-stable nature and compatibility with standard purification methods make it well-suited for iterative synthesis in medicinal chemistry and process development workflows.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H227-H315-H319-H335
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   46.53
  • LogP   1.1006
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   2

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