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2-(2-((Ethylthio)methyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

  • CAS No. 121114-64-5

  • Cat. No. CS-0176689
  • Purity≥98%
  • MDL No.None

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

2-(2-((Ethylthio)methyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane|CS-0176689

Structure of 121114-64-5

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General Information

  • CAS No. 121114-64-5
  • Cat. No. CS-0176689
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₅H₂₃BO₂S
  • Molecular Weight 278.22
  • Synonym(s) 1,3,2-Dioxaborolane, 2-[2-[(ethylthio)methyl]phenyl]-4,4,5,5-tetramethyl-
  • SMILES CC1(C)C(C)(C)OB(C2=CC=CC=C2CSCC)O1

Synthesis

  • Route1
    • In-stock
      2,3-Dimethylbutane-2,3-diol|CS-0015356
      76-09-5
    • null|null
      121-43-7
    • 2-(S-Ethylthiomethyl)-1-bromobenzene|CS-0208556
      99180-11-7
    • ~37%
    • 2-(2-((Ethylthio)methyl)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane|CS-0176689
      121114-64-5

    References

    • Oki, Michinori; Yamada, Yasuhisa Bulletin of the Chemical Society of Japan, 1988 , vol. 61, p. 1191 - 1194
  • Route2

    References

    • Cody, John; Dennisson, Jeanette; Gilmore, Joshua; VanDerveer, Donald G.; Henary, Maged M.; Gabrielli, Alan; Sherrill, C. David; Zhang, Yiyun; Pan, Chia-Pin; Burda, Clemens; Fahrni, Christoph J. Inorganic Chemistry, 2003 , vol. 42, # 16 p. 4918 - 4929

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-P330-P362+P364-P405-P501

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Computational Chemistry Data

  • TPSA   18.46
  • LogP   3.2389
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   4

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