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CS-W001157 4
Total: USD 88.00

5,5-Dimethyl-2-(4-nitrophenyl)-1,3,2-dioxaborinane

  • CAS No. 502622-85-7

  • Cat. No. CS-0153786
  • Molecule weight235.04
  • Purity≥97%
  • MDL No.MFCD03701688

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

5,5-Dimethyl-2-(4-nitrophenyl)-1,3,2-dioxaborinane|CS-0153786

Structure of 502622-85-7

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General Information

  • CAS No. 502622-85-7
  • Cat. No. CS-0153786
  • Purity ≥97%
  • MDL No. MFCD03701688
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄BNO₄
  • Molecular Weight 235.04
  • Synonym(s) 4-Nitrophenylboronic acid neopentylglycol ester
  • SMILES CC1(C)COB(C2=CC=C(C=C2)[N+](=O)[O-])OC1

Synthesis

  • Route1
    • null|null
      586-78-7
    • In-stock
      Bis(neopentyl glycolato)diboron|CS-W009029
      201733-56-4
    • ~53%
    • In-stock
      5,5-Dimethyl-2-(4-nitrophenyl)-1,3,2-dioxaborinane|CS-0153786
      502622-85-7

    References

    • Takaya, Jun; Tadami, Satoshi; Ukai, Kazutoshi; Iwasawa, Nobuharu Organic Letters, 2008 , vol. 10, # 13 p. 2697 - 2700
  • Route2
    • null|null
      668987-38-0
    • null|null
      100-00-5
    • ~%
    • In-stock
      5,5-Dimethyl-2-(4-nitrophenyl)-1,3,2-dioxaborinane|CS-0153786
      502622-85-7

    References

    • Wilson, Daniela A.; Wilson, Christopher J.; Rosen, Brad M.; Percec, Virgil Organic Letters, 2008 , vol. 10, # 21 p. 4879 - 4882
  • Route3

    References

    • Bello, Charles S.; Schmidt-Leithoff, Joachim Tetrahedron Letters, 2012 , vol. 53, # 46 p. 6230 - 6235,6

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

Quality Control

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Computational Chemistry Data

  • TPSA   61.6
  • LogP   1.363
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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