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

  • CAS No. 882679-40-5

  • Cat. No. CS-0041218
  • Purity≥97%
  • MDL No.MFCD11520530

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

Methyl 4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate|CS-0041218

Structure of 882679-40-5

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General Information

  • CAS No. 882679-40-5
  • Cat. No. CS-0041218
  • Purity ≥97%
  • MDL No. MFCD11520530
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₂₁BO₄
  • Molecular Weight 276.14
  • Synonym(s) 5-(Methoxycarbonyl)-2-Methylphenylboronic Acid Pinacol Ester
  • SMILES O=C(OC)C1=CC=C(C)C(B2OC(C)(C)C(C)(C)O2)=C1

Synthesis

  • Route1

    References

    • 3-V BIOSCIENCES, INC.; OSLOB, Johan D.; MCDOWELL, Robert S.; JOHNSON, Russell; YANG, Hanbiao; EVANCHIK, Marc; ZAHARIA, Cristiana A.; CAI, Haiying; HU, Lily W. Patent: WO2014/8197 A1, 2014 ; Location in patent: Page/Page column 71; 72 ;
  • Route2

    References

    • Li, Hengye; Wang, Heye; Liu, Yunchun; Liu, Zhen Chemical Communications, 2012 , vol. 48, # 34 p. 4115 - 4117
  • Route3
    • null|null
      1350764-46-3
    • null|null
      25015-63-8
    • ~63%
    • In-stock
      Methyl 4-methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate|CS-0041218
      882679-40-5

    References

    • Murata, Miki; Oda, Takeshi; Sogabe, Yosuke; Tone, Hirofumi; Namikoshi, Takeshi; Watanabe, Shinji Chemistry Letters, 2011 , vol. 40, # 9 p. 962 - 963

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   2.08082
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   2

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