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CS-W001157 4
Total: USD 88.00

Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate

  • CAS No. 171364-80-0

  • Cat. No. CS-W000882
  • Purity≥98%
  • MDL No.MFCD02179438

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

Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate|CS-W000882

Structure of 171364-80-0

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General Information

  • CAS No. 171364-80-0
  • Cat. No. CS-W000882
  • Purity ≥98%
  • MDL No. MFCD02179438
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₁₉BO₄
  • Molecular Weight 262.11
  • Synonym(s) methyl 4-[hydroxy(2-hydroxy-1,1,2-trimethylpropoxy)boranyl]benzoate
  • SMILES COC(=O)c1ccc(cc1)B1OC(C(O1)(C)C)(C)C

Synthesis

  • Route1

    References

    • Lu, Jie; Guan, Zhong-Zhi; Gao, Jian-Wu; Zhang, Zhan-Hui Applied Organometallic Chemistry, 2011 , vol. 25, # 7 p. 537 - 541
  • Route2

    References

    • Yamamoto, Tetsuya; Morita, Tomoyuki; Takagi, Jun; Yamakawa, Tetsu Organic Letters, 2011 , vol. 13, # 21 p. 5766 - 5769
  • Route3
    • In-stock
      Phenyl trifluoromethanesulfonate|CS-0121626
      17763-67-6
    • null|null
      17763-71-2
    • ~80%
    • In-stock
      Methyl 4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate|CS-W000882
      171364-80-0

    References

    • Ishiyama, Tatsuo; Itoh, Yoshiya; Kitano, Takahiro; Miyaura, Norio Tetrahedron Letters, 1997 , vol. 38, # 19 p. 3447 - 3450

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-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   44.76
  • LogP   1.7724
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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