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CS-W001157 4
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trans-(4-(Trifluoromethyl)cyclohexyl)methanol

  • CAS No. 1202577-61-4

  • Cat. No. CS-0049628
  • Purity≥97%
  • MDL No.None

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

trans-(4-(Trifluoromethyl)cyclohexyl)methanol|CS-0049628

Structure of 1202577-61-4

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General Information

  • CAS No. 1202577-61-4
  • Cat. No. CS-0049628
  • Purity ≥97%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₃F₃O
  • Molecular Weight 182.18
  • Synonym(s) trans-4-(Trifluoromethyl)cyclohexanemethanol
  • SMILES OC[C@H]1CC[C@@H](CC1)C(F)(F)F

Description

trans-(4-(Trifluoromethyl)cyclohexyl)methanol features a rigid, bench-stable cyclohexane scaffold with a para-trifluoromethyl substituent and a primary alcohol group. This configuration enables selective functionalization in synthetic workflows, particularly in medicinal chemistry applications requiring enhanced metabolic stability and lipophilicity.

Application

trans-(4-(Trifluoromethyl)cyclohexyl)methanol serves as a versatile building block for medicinal chemistry and agrochemical synthesis, offering a stable, bench-ready cyclohexane scaffold with orthogonal functional handles. Its trifluoromethyl group enhances metabolic stability and lipophilicity, while the primary alcohol enables straightforward derivatization via esterification, ether formation, or oxidation to aldehyde/carboxylic acid. The trans-configuration provides defined stereochemistry critical for structure-activity studies, and the compound exhibits excellent handling properties and purification compatibility in standard synthetic workflows.

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 : 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   20.23
  • LogP   2.3474
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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