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CS-W001157 4
Total: USD 88.00

2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)phenol

  • CAS No. 779331-13-4

  • Cat. No. CS-0189711
  • Purity≥97%
  • MDL No.None

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

2-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)-4-(trifluoromethyl)phenol|CS-0189711

Structure of 779331-13-4

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General Information

  • CAS No. 779331-13-4
  • Cat. No. CS-0189711
  • Purity ≥97%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₆BF₃O₃
  • Molecular Weight 288.07
  • Synonym(s) None
  • SMILES CC1(C)C(C)(C)OB(C2=C(C=CC(=C2)C(F)(F)F)O)O1

Synthesis

  • Route1

    References

    • LIGAND PHARMACEUTICALS INC. Patent: WO2009/89192 A1, 2009 ; Location in patent: Page/Page column 23-24 ; WO 2009/089192 A1
  • Route2

    References

    • ASTRAZENECA AB Patent: WO2004/89885 A1, 2004 ; Location in patent: Page 95 ; WO 2004/089885 A1

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
Precautionary Statements : P264-P270-P280-P302+P352-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   38.69
  • LogP   2.7102
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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