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CS-W001157 4
Total: USD 88.00

5-Bromoisophthalic acid

  • CAS No. 23351-91-9

  • Cat. No. CS-0040380
  • Purity≥98%
  • MDL No.MFCD00152019

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

5-Bromoisophthalic acid|CS-0040380

Structure of 23351-91-9

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General Information

  • CAS No. 23351-91-9
  • Cat. No. CS-0040380
  • Purity ≥98%
  • MDL No. MFCD00152019
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₅BrO₄
  • Molecular Weight 245.03
  • Synonym(s) 5-Bromobenzene-1,3-dicarboxylic acid
  • SMILES O=C(O)C1=CC(Br)=CC(=C1)C(=O)O

Application

5-Bromoisophthalic acid serves as a versatile building block in synthetic organic chemistry, enabling direct functionalization at the aromatic ring and carboxylic acid termini. Its bromine substituent facilitates palladium-catalyzed cross-coupling reactions, while the two ortho-carboxylic acid groups offer compatibility with amide formation, esterification, and cyclization processes. The compound exhibits excellent bench stability and is readily purified by recrystallization, making it ideal for use in the synthesis of heterocyclic scaffolds, pharmaceutical intermediates, and functional materials.

Safety Information

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GHS Pictogram :
GHS No : GHS06
Signal Word : Danger
UN#: 2811
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   74.6
  • LogP   1.8455
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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