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(S)-5,6-Difluoro-2,3-dihydro-1H-inden-1-amine hydrochloride

  • CAS No. 1029689-74-4

  • Cat. No. CS-0095511
  • Purity≥97%
  • MDL No.MFCD22393185

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

(S)-5,6-Difluoro-2,3-dihydro-1H-inden-1-amine hydrochloride|CS-0095511

Structure of 1029689-74-4

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General Information

  • CAS No. 1029689-74-4
  • Cat. No. CS-0095511
  • Purity ≥97%
  • MDL No. MFCD22393185
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀ClF₂N
  • Molecular Weight 205.63
  • Synonym(s) (S)-5,6-DIFLUORO-INDAN-1-YLAMINE HYDROCHLORIDE
  • SMILES N[C@H]1CCC2=C1C=C(F)C(F)=C2.[H]Cl

Description

(S)-5,6-Difluoro-2,3-dihydro-1H-inden-1-amine hydrochloride features a chiral indenamine core with fluorine atoms at the 5 and 6 positions, enhancing metabolic stability and modulating electronic properties. This bench-stable salt serves as a key building block in asymmetric synthesis, particularly for bioactive molecules requiring rigid, electron-deficient scaffolds.

Application

(S)-5,6-Difluoro-2,3-dihydro-1H-inden-1-amine hydrochloride serves as a versatile chiral building block for the synthesis of fluorinated indoline scaffolds. Its defined stereochemistry and stable hydrochloride salt form facilitate handling and purification. The difluorinated aromatic core enables enhanced metabolic stability and modulated lipophilicity in medicinal chemistry applications, while the primary amine functionality supports diverse downstream transformations including reductive amination, acylation, and coupling reactions.

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   2.3326
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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