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CS-W001157 4
Total: USD 88.00

4-[(phenylcarbamoyl)amino]benzoic acid

  • CAS No. 5467-09-4

  • Cat. No. CS-0232246
  • Molecule weight256.26
  • Purity≥98%
  • MDL No.None

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

4-[(phenylcarbamoyl)amino]benzoic acid|CS-0232246

Structure of 5467-09-4

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General Information

  • CAS No. 5467-09-4
  • Cat. No. CS-0232246
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, sealed storage, away from moisture
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₂N₂O₃
  • Molecular Weight 256.26
  • Synonym(s) 4-[(Anilinocarbonyl)amino]benzoic acid
  • SMILES O=C(O)C1=CC=C(NC(NC2=CC=CC=C2)=O)C=C1

Synthesis

  • Route1

    References

    • Breitler, Simon; Oldenhuis, Nathan J.; Fors, Brett P.; Buchwald, Stephen L. Organic Letters, 2011 , vol. 13, # 12 p. 3262 - 3265
  • Route2
    • null|null
      103-71-9
    • 4-Aminobenzoic acid Conivaptan Impurity|CS-0213989
      150-13-0
    • ~81%
    • 4-[(phenylcarbamoyl)amino]benzoic acid|CS-0232246
      5467-09-4

    References

    • Baures, Paul W.; Oza, Vibha B.; Peterson, Scott A.; Kelly, Jeffery W. Bioorganic and Medicinal Chemistry, 1999 , vol. 7, # 7 p. 1339 - 1347
  • Route3
    • Ethyl 4-(3-phenylureido)benzoate|CS-0361540
      13142-97-7
    • ~%
    • 4-[(phenylcarbamoyl)amino]benzoic acid|CS-0232246
      5467-09-4

    References

    • Bokarew Zhurnal Obshchei Khimii, 1959 , vol. 29, p. 1358,1362; engl. Ausg. S. 1334, 1337

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07,GHS09
Signal Word : Warning
UN#: 3077
Class : 9
Packing Group : Ⅲ
Hazard Statements : H302-H319-H411
Precautionary Statements : P264-P270-P273-P280-P305+P351+P338-P330-P391-P501

Quality Control

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Computational Chemistry Data

  • TPSA   78.43
  • LogP   3.0288
  • H_Acceptors   2
  • H_Donors   3
  • Rotatable_Bonds   3

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