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CS-W001157 4
Total: USD 88.00

3-Bromobenzimidamide hydrochloride

  • CAS No. 16796-52-4

  • Cat. No. CS-D1558
  • Purity≥97%
  • MDL No.MFCD04114439

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

3-Bromobenzimidamide hydrochloride|CS-D1558

Structure of 16796-52-4

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General Information

  • CAS No. 16796-52-4
  • Cat. No. CS-D1558
  • Purity ≥97%
  • MDL No. MFCD04114439
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₈BrClN₂
  • Molecular Weight 235.51
  • Synonym(s) 3-Bromobenzamidine hydrochloride; 3-Bromobenzamidine monohydrochloride; 3-bromobenzamidinehydrochloride
  • SMILES N=C(C1=CC=CC(Br)=C1)N.[H]Cl

Description

3-Bromobenzimidamide hydrochloride offers a brominated benzimidazole scaffold with enhanced solubility and stability under standard conditions. This bench-stable derivative integrates readily into synthetic workflows requiring halogenated heterocycles, enabling efficient coupling reactions and facilitating downstream functionalization in medicinal chemistry applications.

Application

3-Bromobenzimidamide hydrochloride serves as a versatile building block in medicinal chemistry, enabling direct incorporation of a brominated benzimidazole scaffold into target molecules. Its stable, crystalline form facilitates handling and purification, while the bromo substituent supports palladium-catalyzed cross-coupling reactions. The amide functionality provides a handle for further derivatization, and the hydrochloride salt enhances solubility and shelf stability—making it well-suited for use in multi-step synthesis and high-throughput screening campaigns.

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   49.87
  • LogP   2.15497
  • H_Acceptors   1
  • H_Donors   2
  • Rotatable_Bonds   1

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