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CS-W001157 4
Total: USD 88.00

1-(2-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)ethyl)pyrrolidine

  • CAS No. 656257-46-4

  • Cat. No. CS-0175642
  • Molecule weight317.23
  • Purity≥98%
  • MDL No.None

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

1-(2-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)ethyl)pyrrolidine|CS-0175642

Structure of 656257-46-4

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General Information

  • CAS No. 656257-46-4
  • Cat. No. CS-0175642
  • Purity ≥98%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₈H₂₈BNO₃
  • Molecular Weight 317.23
  • Synonym(s) 1-(2-[4-(4,4,5,5-TETRAMETHYL-[1,3,2]DIOXABOROLAN-2-YL)-PHENOXY]-ETHYL)-PYRROLIDINE
  • SMILES CC1(C(C)(OB(O1)C2=CC=C(OCCN3CCCC3)C=C2)C)C

Synthesis

  • Route1
    • 1-(2-(4-Bromophenoxy)ethyl)pyrrolidine|CS-0006699
      1081-73-8
    • In-stock
      Bis(pinacolato)diborane|CS-D1216
      73183-34-3
    • ~47%
    • In-stock
      1-(2-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)ethyl)pyrrolidine|CS-0175642
      656257-46-4

    References

    • ASTRAZENECA AB; ASTRAZENECA UK LIMITED Patent: WO2008/84223 A2, 2008 ; Location in patent: Page/Page column 157 ; WO 2008/084223 A2
  • Route2
    • 1-(2-(4-Iodophenoxy)Ethyl)pyrrolidine|CS-0764613
      554430-67-0
    • null|null
      25015-63-8
    • ~99%
    • In-stock
      1-(2-(4-(4,4,5,5-Tetramethyl-1,3,2-dioxaborolan-2-yl)phenoxy)ethyl)pyrrolidine|CS-0175642
      656257-46-4

    References

    • SMITHKLINE BEECHAM CORPORATION Patent: WO2004/13125 A1, 2004 ; Location in patent: Page 20-21 ; WO 2004/013125 A1

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H317-H319
Precautionary Statements : P261-P264-P272-P280-P302+P352-P362+P364-P501

Quality Control

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Computational Chemistry Data

  • TPSA   30.93
  • LogP   2.4604
  • H_Acceptors   4
  • H_Donors   0
  • Rotatable_Bonds   5

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