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CS-W001157 4
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Methyl 4-hydroxycyclohexane-1-carboxylate

  • CAS No. 17449-76-2

  • Cat. No. CS-W002672
  • Purity≥98%
  • MDL No.MFCD00729087

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

Methyl 4-hydroxycyclohexane-1-carboxylate|CS-W002672

Structure of 17449-76-2

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General Information

  • CAS No. 17449-76-2
  • Cat. No. CS-W002672
  • Purity ≥98%
  • MDL No. MFCD00729087
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₄O₃
  • Molecular Weight 158.19
  • Synonym(s) methyl 4-oxo-cyclohexanecarboxylate
  • SMILES O=C(C1CCC(O)CC1)OC

Description

Methyl 4-hydroxycyclohexane-1-carboxylate features a cyclohexane ring bearing both hydroxyl and ester functionalities in a trans configuration, offering enhanced stability and solubility. This structural motif enables efficient incorporation into complex synthetic sequences, particularly in the development of bioactive molecules and chiral intermediates.

Application

Methyl 4-hydroxycyclohexane-1-carboxylate serves as a versatile chiral building block in synthetic organic chemistry, enabling efficient access to functionalized cyclohexane scaffolds. The pendant hydroxyl and ester groups offer orthogonal reactivity for selective derivatization, including protection, oxidation, and coupling reactions. Its bench-stable nature and compatibility with standard purification methods make it well-suited for multi-step synthesis workflows in medicinal chemistry and process development.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-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   0.7105
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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