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7-Bromoquinoline-3-carbonitrile

  • CAS No. 1375108-40-9

  • Cat. No. CS-0041777
  • Purity≥97%
  • MDL No.MFCD23163823

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

7-Bromoquinoline-3-carbonitrile|CS-0041777

Structure of 1375108-40-9

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General Information

  • CAS No. 1375108-40-9
  • Cat. No. CS-0041777
  • Purity ≥97%
  • MDL No. MFCD23163823
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₅BrN₂
  • Molecular Weight 233.06
  • Synonym(s) 7-methylquinoline-3-carbonitrile
  • SMILES N#CC1=CC2=CC=C(Br)C=C2N=C1

Description

7-Bromoquinoline-3-carbonitrile is a heterocyclic building block featuring a bromine atom at the 7-position and a nitrile group at the 3-position of the quinoline core. This combination enables direct functionalization in palladium-catalyzed cross-coupling reactions, offering high reactivity and stability under standard conditions. The electron-deficient quinoline scaffold enhances compatibility with nucleophilic substitution processes.

Application

7-Bromoquinoline-3-carbonitrile serves as a versatile building block in medicinal chemistry and catalytic synthesis, enabling efficient construction of quinoline-based scaffolds. The bromine and nitrile groups provide orthogonal handles for palladium-catalyzed cross-coupling and nucleophilic transformations, respectively. Its bench-stable nature and compatibility with diverse reaction conditions facilitate straightforward purification and integration into multi-step syntheses.

Safety Information

Download SDS
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   36.68
  • LogP   2.86898
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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