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CS-W001157 4
Total: USD 88.00

rel-((1R,4R)-4-(Trifluoromethyl)cyclohexanamine)

  • CAS No. 1073266-02-0

  • Cat. No. CS-0063870
  • Purity≥96%
  • MDL No.MFCD18914322

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

rel-((1R,4R)-4-(Trifluoromethyl)cyclohexanamine)|CS-0063870

Structure of 1073266-02-0

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General Information

  • CAS No. 1073266-02-0
  • Cat. No. CS-0063870
  • Purity ≥96%
  • MDL No. MFCD18914322
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₂F₃N
  • Molecular Weight 167.17
  • Synonym(s) trans-4-(Trifluoromethyl)cyclohexanamine
  • SMILES N[C@H]1CC[C@H](C(F)(F)F)CC1

Description

This rel-((1R,4R)-4-(trifluoromethyl)cyclohexanamine) features a rigid, stereodefined cyclohexane scaffold with a trifluoromethyl group at the C4 position, conferring enhanced lipophilicity and metabolic stability. The amine functionality enables straightforward derivatization for medicinal chemistry applications.

Application

rel-((1R,4R)-4-(Trifluoromethyl)cyclohexanamine) serves as a valuable chiral building block in medicinal chemistry, enabling the construction of bioactive heterocycles and pharmaceutical scaffolds. Its trifluoromethyl group enhances metabolic stability and lipophilicity, while the cyclohexanamine core provides a rigid, stereochemically defined platform for functionalization. The compound exhibits excellent bench stability and compatibility with standard coupling and reduction protocols, facilitating efficient synthesis of target molecules in drug discovery campaigns.

Safety Information

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GHS Pictogram :
GHS No : GHS02,GHS05
Signal Word : Danger
UN#: 2734
Class : 8 (3)
Packing Group : Ⅱ
Hazard Statements : H226-H314
Precautionary Statements : P210-P233-P240-P241-P242-P264-P280-P301+P330+P331-P304+P340-P370+P378-P405

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Computational Chemistry Data

  • TPSA   26.02
  • LogP   2.0662
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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