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CS-W001157 4
Total: USD 88.00

Isopropoxybenzene

  • CAS No. 2741-16-4

  • Cat. No. CS-0154152
  • Purity≥97%
  • MDL No.MFCD00048288

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

Isopropoxybenzene|CS-0154152

Structure of 2741-16-4

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General Information

  • CAS No. 2741-16-4
  • Cat. No. CS-0154152
  • Purity ≥97%
  • MDL No. MFCD00048288
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₂O
  • Molecular Weight 136.19
  • Synonym(s) 1-isopropoxybenzene
  • SMILES CC(C)OC1=CC=CC=C1

Description

Isopropoxybenzene features a para-substituted isopropoxy group attached to a benzene ring, delivering enhanced solubility in organic media and improved stability under standard conditions. This aryl ether integrates readily into synthetic sequences requiring robust, moisture-tolerant aromatic linkages.

Application

Isopropoxybenzene serves as a stable, bench-friendly aryl ether intermediate that facilitates electrophilic aromatic substitution and Suzuki-Miyaura coupling reactions. Its isopropoxy group provides enhanced solubility and stability compared to smaller alkoxy counterparts, enabling efficient functionalization in late-stage diversification of pharmaceutical and agrochemical scaffolds.

Synthesis

  • Route1
    • null|null
      75-26-3
    • null|null
      108-95-2
    • ~88%
    • In-stock
      Isopropoxybenzene|CS-0154152
      2741-16-4

    References

    • Xu, Zhen Yuan; Xu, Dan Qian; Liu, Bao You Organic Preparations and Procedures International, 2004 , vol. 36, # 2 p. 156 - 161
  • Route2
    • null|null
      27350-46-5
    • null|null
      108-95-2
    • ~79%
    • In-stock
      Isopropoxybenzene|CS-0154152
      2741-16-4

    References

    • Shintou, Taichi; Kikuchi, Wataru; Mukaiyama, Teruaki Chemistry Letters, 2003 , vol. 32, # 1 p. 22 - 23 Title/Abstract Full Text View citing articles Show Details Shintou, Taichi; Kikuchi, Wataru; Mukaiyama, Teruaki Bulletin of the Chemical Society of Japan, 2003 , vol. 76, # 8 p. 1645 - 1667 Title/Abstract Full Text View citing articles Show Details Shintou, Taichi; Mukaiyama, Teruaki Journal of the American Chemical Society, 2004 , vol. 126, # 23 p. 7359 - 7367
  • Route3
    • null|null
      108-86-1
    • null|null
      107-31-3
    • ~%
    • In-stock
      Isopropoxybenzene|CS-0154152
      2741-16-4

    References

    • Sterling Drug Inc. Patent: US4495353 A1, 1985 ;

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

Quality Control

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Computational Chemistry Data

  • TPSA   9.23
  • LogP   2.4738
  • H_Acceptors   1
  • H_Donors   0
  • Rotatable_Bonds   2

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