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CS-W001157 4
Total: USD 88.00

2-(3-Bromo-5-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

  • CAS No. 401797-04-4

  • Cat. No. CS-0173898
  • Molecule weight313.00
  • Purity≥98%
  • MDL No.None

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

2-(3-Bromo-5-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane|CS-0173898

Structure of 401797-04-4

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General Information

  • CAS No. 401797-04-4
  • Cat. No. CS-0173898
  • Purity ≥98%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₈BBrO₃
  • Molecular Weight 313.00
  • Synonym(s) 3-BroMo-5-Methoxyphenylboronic acid pinacol ester
  • SMILES CC1(C(C)(OB(O1)C2=CC(Br)=CC(OC)=C2)C)C

Synthesis

  • Route1
    • null|null
      2398-37-0
    • In-stock
      Bis(pinacolato)diborane|CS-D1216
      73183-34-3
    • ~77%
    • In-stock
      2-(3-Bromo-5-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane|CS-0173898
      401797-04-4

    References

    • Boebel, Timothy A.; Hartwig, John F. Tetrahedron, 2008 , vol. 64, # 29 p. 6824 - 6830
  • Route2
    • null|null
      2398-37-0
    • ~76%
    • In-stock
      2-(3-Bromo-5-methoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane|CS-0173898
      401797-04-4

    References

    • Zeqing, Li; Zhibin, Liang; Yuqiang, Wang; Pei, Yu Research on Chemical Intermediates, 2013 , vol. 39, # 4 p. 1917 - 1926

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   27.69
  • LogP   2.7569
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   2

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