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CS-W001157 4
Total: USD 88.00

4-(2,6-Dichlorobenzamido)-1H-pyrazole-3-carboxylic acid

  • CAS No. 825619-04-3

  • Cat. No. CS-M2527
  • Purity≥98%
  • MDL No.None

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

4-(2,6-Dichlorobenzamido)-1H-pyrazole-3-carboxylic acid|CS-M2527

Structure of 825619-04-3

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General Information

  • CAS No. 825619-04-3
  • Cat. No. CS-M2527
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₇Cl₂N₃O₃
  • Molecular Weight 300.10
  • Synonym(s) 1H-Pyrazole-3-carboxylic acid, 4-[(2,6-dichlorobenzoyl)amino]-
  • SMILES O=C(C(C(Cl)=CC=C1)=C1Cl)NC2=CNN=C2C(O)=O

Synthesis

  • Route1
    • null|null
      825619-05-4
    • ~99%
    • In-stock
      4-(2,6-Dichlorobenzamido)-1H-pyrazole-3-carboxylic acid|CS-M2527
      825619-04-3

    References

    • ASTEX THERAPEUTICS LIMITED Patent: WO2008/9954 A1, 2008 ; Location in patent: Page/Page column 83; 85-86; 106-107 ; WO 2008/009954 A1
  • Route2

    References

    • ASTEX THERAPEUTICS LIMITED; NOVARTIS AG Patent: WO2008/7123 A2, 2008 ; Location in patent: Page/Page column 112 ; WO 2008/007123 A2
  • Route3

    References

    • ASTEX THERAPEUTICS LIMITED Patent: WO2006/77426 A2, 2006 ; Location in patent: Page/Page column 97 ; WO 2006/077426 A2

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-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   95.08
  • LogP   2.667
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   3

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