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(S)-1-(2,6-Difluorophenyl)ethanamine hydrochloride

  • CAS No. 1309598-68-2

  • Cat. No. CS-0040294
  • Purity≥97%
  • MDL No.MFCD12757708

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

(S)-1-(2,6-Difluorophenyl)ethanamine hydrochloride|CS-0040294

Structure of 1309598-68-2

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General Information

  • CAS No. 1309598-68-2
  • Cat. No. CS-0040294
  • Purity ≥97%
  • MDL No. MFCD12757708
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₁₀ClF₂N
  • Molecular Weight 193.62
  • Synonym(s) (S)-1-(2,6-Difluorophenyl)ethylamine hydrochloride
  • SMILES [H]Cl.FC1=C([C@H](C)N)C(F)=CC=C1

Description

(S)-1-(2,6-Difluorophenyl)ethanamine hydrochloride is a chiral amine featuring a sterically constrained aromatic core with dual fluorine substituents. This configuration imparts enhanced metabolic stability and favorable binding affinity in asymmetric synthesis applications. The hydrochloride salt form ensures high solubility and ease of handling under standard bench conditions.

Application

(S)-1-(2,6-Difluorophenyl)ethanamine hydrochloride serves as a chiral building block for asymmetric synthesis, enabling the construction of pharmaceutically relevant scaffolds. Its bench-stable hydrochloride salt form enhances handling and solubility, while the ortho-difluoro substitution provides enhanced metabolic stability and modulates electronic properties. The compound functions effectively in amine coupling reactions, reductive amination, and transition-metal-catalyzed transformations, offering high enantiomeric purity and compatibility with standard purification techniques.

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   26.02
  • LogP   2.4063
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   1

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