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CS-W001157 4
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Ethyl 2-(2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetate

  • CAS No. 1228690-72-9

  • Cat. No. CS-0173948
  • Purity≥98%
  • MDL No.None

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

Ethyl 2-(2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)acetate|CS-0173948

Structure of 1228690-72-9

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General Information

  • CAS No. 1228690-72-9
  • Cat. No. CS-0173948
  • Purity ≥98%
  • MDL No. None
  • Storage RT, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₂₃BO₄
  • Molecular Weight 290.16
  • Synonym(s) Benzeneacetic acid, 2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, ethyl ester
  • SMILES CCOC(CC1=CC=CC=C1B2OC(C)(C(C)(O2)C)C)=O

Synthesis

  • Route1

    References

    • Scott, Jill M.; Baccei, Christopher; Bain, Gretchen; Broadhead, Alex; Evans, Jilly F.; Fagan, Patrick; Hutchinson, John H.; King, Christopher; Lorrain, Daniel S.; Lee, Catherine; Prasit, Peppi; Prodanovich, Pat; Santini, Angelina; Santini, Brian A. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 21 p. 6608 - 6612
  • Route2

    References

    • Scott, Jill M.; Baccei, Christopher; Bain, Gretchen; Broadhead, Alex; Evans, Jilly F.; Fagan, Patrick; Hutchinson, John H.; King, Christopher; Lorrain, Daniel S.; Lee, Catherine; Prasit, Peppi; Prodanovich, Pat; Santini, Angelina; Santini, Brian A. Bioorganic and Medicinal Chemistry Letters, 2011 , vol. 21, # 21 p. 6608 - 6612

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

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Computational Chemistry Data

  • TPSA   44.76
  • LogP   2.0914
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   4

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