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Isoquinoline, 6-fluoro-1,2,3,4-tetrahydro-, hydrochloride

  • CAS No. 799274-08-1

  • Cat. No. CS-0028393
  • Molecule weight187.64
  • Purity≥97%
  • MDL No.MFCD08437639

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

Isoquinoline, 6-fluoro-1,2,3,4-tetrahydro-, hydrochloride|CS-0028393

Structure of 799274-08-1

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General Information

  • CAS No. 799274-08-1
  • Cat. No. CS-0028393
  • Purity ≥97%
  • MDL No. MFCD08437639
  • Storage -20°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₁ClFN
  • Molecular Weight 187.64
  • Synonym(s) 6-FLUORO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE HYDROCHLORIDE
  • SMILES FC1=CC=C(CNCC2)C2=C1.[H]Cl

Description

6-Fluoro-1,2,3,4-tetrahydroisoquinoline hydrochloride features a fluorinated tetrahydroisoquinoline core with enhanced metabolic stability and improved membrane permeability. This bench-stable salt form facilitates handling in synthetic workflows, enabling efficient incorporation into bioactive molecules for medicinal chemistry applications.

Application

6-Fluoro-1,2,3,4-tetrahydroisoquinoline hydrochloride serves as a valuable building block in medicinal chemistry, enabling efficient access to bioactive isoquinoline scaffolds. Its fluorinated aromatic core enhances metabolic stability and modulates electronic properties, while the protonated amine facilitates salt formation for improved solubility and handling. The compound exhibits robust functional group tolerance and participates reliably in standard coupling reactions, making it well-suited for the synthesis of CNS-targeted therapeutics and kinase inhibitors.

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   12.03
  • LogP   1.8932
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   0

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