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2-(Pyridin-3-yl)-1h-1,3-benzodiazole-6-carboxylic acid

  • CAS No. 312496-16-5

  • Cat. No. CS-0126810
  • Purity≥95%
  • MDL No.MFCD01414693

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

2-(Pyridin-3-yl)-1h-1,3-benzodiazole-6-carboxylic acid|CS-0126810

Structure of 312496-16-5

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General Information

  • CAS No. 312496-16-5
  • Cat. No. CS-0126810
  • Purity ≥95%
  • MDL No. MFCD01414693
  • Storage RT, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₉N₃O₂
  • Molecular Weight 239.23
  • Synonym(s) 2-pyridin-3-yl-3H-benzoimidazole-5-carboxylic Acid
  • SMILES O=C(C1=CC=C2N=C(C3=CC=CN=C3)NC2=C1)O

Synthesis

  • Route1
    • null|null
      500-22-1
    • In-stock
      4-Carboxyphenyldiamine|CS-D1364
      619-05-6
    • ~%
    • In-stock
      2-(Pyridin-3-yl)-1h-1,3-benzodiazole-6-carboxylic acid|CS-0126810
      312496-16-5

    References

    • Wubulikasimu, Reyila; Yang, Yanbing; Xue, Fei; Luo, Xianjin; Shao, Dongping; Li, Yuhuan; Gao, Rongmei; Ye, Weidong Bulletin of the Korean Chemical Society, 2013 , vol. 34, # 8 p. 2297 - 2304

Safety Information

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GHS Pictogram :
GHS No : GHS07,GHS09
Signal Word : Warning
UN#: 3077
Class : 9
Packing Group : Ⅲ
Hazard Statements : H315-H319-H400
Precautionary Statements : P264-P273-P280-P302+P352-P362+P364-P391-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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