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CS-W001157 4
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2-(Pyridin-4-yl)-1H-benzo[d]imidazole-7-carboxylic acid

  • CAS No. 124340-93-8

  • Cat. No. CS-0090686
  • Purity≥96%
  • MDL No.MFCD10565682

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

2-(Pyridin-4-yl)-1H-benzo[d]imidazole-7-carboxylic acid|CS-0090686

Structure of 124340-93-8

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General Information

  • CAS No. 124340-93-8
  • Cat. No. CS-0090686
  • Purity ≥96%
  • MDL No. MFCD10565682
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₉N₃O₂
  • Molecular Weight 239.23
  • Synonym(s) 2-Pyridin-4-yl-3H-benzoimidazole-4-carboxylic acid
  • SMILES O=C(C1=C2C(N=C(C3=CC=NC=C3)N2)=CC=C1)O

Synthesis

  • Route1

    References

    • Bioorganic and Medicinal Chemistry, , vol. 19, # 8 p. 2641 - 2649
  • Route2

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 15, # 2 p. 267 - 269
  • Route3
    • Ethyl 2-amino-3-nitrobenzoate|CS-0823530
      61063-11-4
    • ~%
    • In-stock
      2-(Pyridin-4-yl)-1H-benzo[d]imidazole-7-carboxylic acid|CS-0090686
      124340-93-8

    References

    • Journal of Medicinal Chemistry, , vol. 33, # 2 p. 814 - 819

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   78.87
  • LogP   2.3231
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   2

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