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CS-W001157 4
Total: USD 88.00

(2-Chloro-3-cyanopyridin-4-yl)boronic acid

  • CAS No. 878194-88-8

  • Cat. No. CS-0053532
  • Molecule weight182.37
  • Purity≥97%
  • MDL No.MFCD09037478

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

(2-Chloro-3-cyanopyridin-4-yl)boronic acid|CS-0053532

Structure of 878194-88-8

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General Information

  • CAS No. 878194-88-8
  • Cat. No. CS-0053532
  • Purity ≥97%
  • MDL No. MFCD09037478
  • Storage -20°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₆H₄BClN₂O₂
  • Molecular Weight 182.37
  • Synonym(s) 2-CHLORO-3-CYANOPYRIDIN-4-YLBORONIC ACID
  • SMILES OB(O)C1=C(C#N)C(Cl)=NC=C1

Synthesis

  • Route1
    • 3-Pyridinecarbonitrile, 2-chloro-|CS-0654103
      6602-54-6
    • ~%
    • (2-Chloro-3-cyanopyridin-4-yl)boronic acid|CS-0053532
      878194-88-8

    References

    • Synlett, , # 1 art. no. G33905ST, p. 53 - 56

Safety Information

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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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   77.14
  • LogP   -0.71352
  • H_Acceptors   4
  • H_Donors   2
  • Rotatable_Bonds   1

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