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CS-W001157 4
Total: USD 88.00

4-Bromobenzonitrile

  • CAS No. 623-00-7

  • Cat. No. CS-W004663
  • Purity≥98%
  • MDL No.MFCD00001811

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

4-Bromobenzonitrile|CS-W004663

Structure of 623-00-7

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General Information

  • CAS No. 623-00-7
  • Cat. No. CS-W004663
  • Purity ≥98%
  • MDL No. MFCD00001811
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₄BrN
  • Molecular Weight 182.02
  • Synonym(s) p-Bromophenyl cyanide; 4-Bromobenzonitrile
  • SMILES N#CC1=CC=C(Br)C=C1

Application

4-Bromobenzonitrile serves as a versatile building block in cross-coupling chemistry, enabling efficient Suzuki and Stille reactions due to its stable aryl bromide and nitrile functionalities. The nitrile group offers orthogonal reactivity for downstream transformations, while the bromine facilitates palladium-catalyzed coupling with broad functional group tolerance. Bench-stable and readily purified by recrystallization, it functions as a key intermediate in the synthesis of pharmaceuticals, agrochemicals, and advanced materials.

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 3439
Class : 6.1
Packing Group : Ⅲ
Hazard Statements : H301
Precautionary Statements : P264-P270-P330-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   23.79
  • LogP   2.32078
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   0

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