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CS-W001157 4
Total: USD 88.00

(3,5-Difluoro-4-(hydroxymethyl)phenyl)boronic acid

  • CAS No. 917969-79-0

  • Cat. No. CS-0175136
  • Purity≥96%
  • MDL No.None

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

(3,5-Difluoro-4-(hydroxymethyl)phenyl)boronic acid|CS-0175136

Structure of 917969-79-0

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General Information

  • CAS No. 917969-79-0
  • Cat. No. CS-0175136
  • Purity ≥96%
  • MDL No. None
  • Storage 4°C, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₇BF₂O₃
  • Molecular Weight 187.94
  • Synonym(s) 3,5-Difluoro-4-(hydroxymethyl)phenylboronic acid
  • SMILES FC1=C(CO)C(F)=CC(B(O)O)=C1

Synthesis

  • Route1
    • 2,6-Difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-benzenemethanol|CS-0189701
      1417736-43-6
    • ~%
    • In-stock
      (3,5-Difluoro-4-(hydroxymethyl)phenyl)boronic acid|CS-0175136
      917969-79-0

    References

    • BAYER INTELLECTUAL PROPERTY GMBH; Bayer Pharma Aktiengesellschaft; KLAR, Jürgen; VOEHRINGER, Verena; TELSER, Joachim; LOBELL, Mario; SÜßMEIER, Frank; LI, Volkhart Min-Jian; BÖTTGER, Michael; GOLZ, Stefan; LANG, Dieter; SCHLEMMER, Karl-Heinz; SCHLANGE, Thomas; SCHALL, Andreas; FU, Wenlang Patent: WO2013/4551 A1, 2013 ; Location in patent: Page/Page column 34 ;
  • Route2

    References

    • BAYER INTELLECTUAL PROPERTY GMBH; Bayer Pharma Aktiengesellschaft; KLAR, Jürgen; VOEHRINGER, Verena; TELSER, Joachim; LOBELL, Mario; SÜßMEIER, Frank; LI, Volkhart Min-Jian; BÖTTGER, Michael; GOLZ, Stefan; LANG, Dieter; SCHLEMMER, Karl-Heinz; SCHLANGE, Thomas; SCHALL, Andreas; FU, Wenlang Patent: WO2013/4551 A1, 2013 ;

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-H312-H332
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P330-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   60.69
  • LogP   -0.8631
  • H_Acceptors   3
  • H_Donors   3
  • Rotatable_Bonds   2

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