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CS-W001157 4
Total: USD 88.00

(1-Methyl-1H-indol-4-yl)boronic acid

  • CAS No. 590417-56-4

  • Cat. No. CS-0138028
  • Molecule weight174.99
  • Purity98+%
  • MDL No.MFCD12964857

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

(1-Methyl-1H-indol-4-yl)boronic acid|CS-0138028

Structure of 590417-56-4

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General Information

  • CAS No. 590417-56-4
  • Cat. No. CS-0138028
  • Purity 98+%
  • MDL No. MFCD12964857
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₀BNO₂
  • Molecular Weight 174.99
  • Synonym(s) B-(1-methyl-1H-indol-4-yl)-Boronic acid
  • SMILES CN1C=CC2=C1C=CC=C2B(O)O

Synthesis

  • Route1

    References

    • Shoda, Motoshi; Kuriyama, Hiroshi Patent: US2004/44258 A1, 2004 ; Location in patent: Page 78 ;
  • Route2

    References

    • Molander, Gary A.; Trice, Sarah L. J.; Kennedy, Steven M.; Dreher, Spencer D.; Tudge, Matthew T. Journal of the American Chemical Society, 2012 , vol. 134, # 28 p. 11667 - 11673

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   45.39
  • LogP   -0.1419
  • H_Acceptors   3
  • H_Donors   2
  • Rotatable_Bonds   1

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