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CS-W001157 4
Total: USD 88.00

4-Thioureidobenzoic acid

  • CAS No. 7366-56-5

  • Cat. No. CS-0149931
  • Purity≥98%
  • MDL No.MFCD00041187

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

4-Thioureidobenzoic acid|CS-0149931

Structure of 7366-56-5

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General Information

  • CAS No. 7366-56-5
  • Cat. No. CS-0149931
  • Purity ≥98%
  • MDL No. MFCD00041187
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₈N₂O₂S
  • Molecular Weight 196.23
  • Synonym(s) Phenylthiourea-4-carboxylicacid
  • SMILES NC(NC1=CC=C(C(O)=O)C=C1)=S

Description

4-Thioureidobenzoic acid features a thiourea group conjugated to a benzoic acid scaffold, enabling dual functionality in bioconjugation and molecular recognition. This derivative combines a reactive thioamide moiety with an acidic carboxylate, facilitating site-specific labeling and integration into peptide or polymer architectures under mild conditions.

Application

4-Thioureidobenzoic acid serves as a versatile building block for the synthesis of heterocyclic scaffolds and bioactive molecules. Its thiourea functionality enables robust hydrogen bonding and metal coordination, while the carboxylic acid group facilitates conjugation via amide or ester linkages. The compound exhibits excellent bench stability and is compatible with standard coupling protocols, enabling efficient incorporation into peptide-like architectures and medicinal chemistry libraries.

Synthesis

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      40611-30-1
    • ~%
    • In-stock
      4-Thioureidobenzoic acid|CS-0149931
      7366-56-5

    References

    • Journal of the American Chemical Society, , vol. 56, p. 1408
  • Route2
    • 4-Aminobenzoic acid Conivaptan Impurity|CS-0213989
      150-13-0
    • ~%
    • In-stock
      4-Thioureidobenzoic acid|CS-0149931
      7366-56-5

    References

    • Journal of Medicinal Chemistry, , vol. 40, # 12 p. 1901 - 1905
  • Route3

    References

    • Bulletin of the Korean Chemical Society, , vol. 33, # 1 p. 111 - 114

Safety Information

Download SDS
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   75.35
  • LogP   1.0403
  • H_Acceptors   2
  • H_Donors   3
  • Rotatable_Bonds   2

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