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CS-W001157 4
Total: USD 88.00

1,4-Benzenediboronic acid bis(neopentyl glycol) ester

  • CAS No. 5565-36-6

  • Cat. No. CS-W000947
  • Purity≥98%
  • MDL No.MFCD01075726

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

1,4-Benzenediboronic acid bis(neopentyl glycol) ester|CS-W000947

Structure of 5565-36-6

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General Information

  • CAS No. 5565-36-6
  • Cat. No. CS-W000947
  • Purity ≥98%
  • MDL No. MFCD01075726
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₂₄B₂O₄
  • Molecular Weight 301.98
  • Synonym(s) 2,2'-(1,4-Phenylene)bis[5,5-dimethyl-1,3,2-dioxaborinane]
  • SMILES CC(COB1C2=CC=C(B3OCC(C)(CO3)C)C=C2)(CO1)C

Synthesis

  • Route1

    References

    • Banerjee, Moloy; Shukla, Ruchi; Rathore, Rajendra Journal of the American Chemical Society, 2009 , vol. 131, p. 1780 - 1786
  • Route2

    References

    • Moldoveanu, Costel; Wilson, Daniela A.; Wilson, Christopher J.; Corcoran, Patrick; Rosen, Brad M.; Percec, Virgil Organic Letters, 2009 , vol. 11, # 21 p. 4974 - 4977
  • Route3

    References

    • Tobisu, Mamoru; Kinuta, Hirotaka; Kita, Yusuke; Remond, Emmanuelle; Chatani, Naoto Journal of the American Chemical Society, 2012 , vol. 134, # 1 p. 115 - 118

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

Quality Control

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Computational Chemistry Data

  • TPSA   36.92
  • LogP   1.223
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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