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7-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-1-oxo-

  • CAS No. 1343932-64-8

  • Cat. No. CS-0161707
  • Molecule weight191.18
  • Purity≥96%
  • MDL No.MFCD19683459

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

7-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-1-oxo-|CS-0161707

Structure of 1343932-64-8

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General Information

  • CAS No. 1343932-64-8
  • Cat. No. CS-0161707
  • Purity ≥96%
  • MDL No. MFCD19683459
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₉NO₃
  • Molecular Weight 191.18
  • Synonym(s) 3,4-Dihydro-2H-isoquinolin-1-one-7-carboxylic acid
  • SMILES O=C(C1=CC2=C(C=C1)CCNC2=O)O

Description

1,2,3,4-Tetrahydro-7-isoquinolinecarboxylic acid delivers a rigid, electron-rich scaffold ideal for medicinal chemistry applications. This bench-stable heterocycle integrates readily into bioactive molecule design, offering enhanced solubility and metabolic stability in drug discovery workflows.

Application

1,2,3,4-Tetrahydro-7-isoquinolinecarboxylic acid serves as a versatile building block for heterocyclic synthesis, enabling efficient access to isoquinoline-based scaffolds. Its carboxylic acid functionality facilitates direct amidation, esterification, and coupling reactions, while the tetrahydroisoquinoline core exhibits favorable stability and solubility for downstream functionalization. This compound functions effectively in medicinal chemistry campaigns targeting CNS-active molecules and offers robust compatibility with standard peptide and transition-metal-catalyzed transformations.

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 : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P304+P340-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   66.4
  • LogP   0.6707
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   1

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