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CS-W001157 4
Total: USD 88.00

4-(Methylcarbamoyl)benzoic acid

  • CAS No. 23754-45-2

  • Cat. No. CS-0151059
  • Purity≥98%
  • MDL No.MFCD10688269

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

4-(Methylcarbamoyl)benzoic acid|CS-0151059

Structure of 23754-45-2

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General Information

  • CAS No. 23754-45-2
  • Cat. No. CS-0151059
  • Purity ≥98%
  • MDL No. MFCD10688269
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₉NO₃
  • Molecular Weight 179.17
  • Synonym(s) 4-[(Methylamino)carbonyl]benzoic acid
  • SMILES CNC(=O)C1=CC=C(C=C1)C(=O)O

Description

4-(Methylcarbamoyl)benzoic acid features a carboxylic acid group flanked by a para-substituted methylcarbamoyl moiety, enabling direct conjugation in peptide and amide synthesis. This polar, bench-stable derivative integrates readily into bioconjugation workflows and supports efficient derivatization under mild conditions.

Application

4-(Methylcarbamoyl)benzoic acid serves as a versatile building block for medicinal chemistry and peptide conjugation, enabling the synthesis of amide-linked bioactive molecules. Its dual carboxylic acid and N-methylcarbamoyl functionality offers orthogonal reactivity, facilitating selective derivatization under standard coupling conditions. The compound exhibits good bench stability and ease of purification, making it well-suited for scalable synthesis and integration into heterocyclic scaffolds or API intermediates.

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-H332-H335
Precautionary Statements : P233-P260-P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P340-P362-P403-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   66.4
  • LogP   0.7444
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   2

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