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CS-W001157 4
Total: USD 88.00

1-(tert-Butyl)-4-iodobenzene

  • CAS No. 35779-04-5

  • Cat. No. CS-W014070
  • Molecule weight260.12
  • Purity≥97%
  • MDL No.MFCD00052339

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

1-(tert-Butyl)-4-iodobenzene|CS-W014070

Structure of 35779-04-5

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General Information

  • CAS No. 35779-04-5
  • Cat. No. CS-W014070
  • Purity ≥97%
  • MDL No. MFCD00052339
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₀H₁₃I
  • Molecular Weight 260.12
  • Synonym(s) BUTTPARK 44-03-82; 1-tert-Butyl-3-iodobenzene
  • SMILES IC1=CC=C(C(C)(C)C)C=C1

Description

1-(tert-Butyl)-4-iodobenzene features a sterically shielded tert-butyl group flanking an iodine-substituted aromatic ring, enhancing stability and facilitating palladium-catalyzed cross-coupling reactions. This robust aryl iodide integrates efficiently into complex molecular architectures under standard conditions, offering reliable access to functionalized biaryls in synthetic chemistry workflows.

Synthesis

  • Route1

    References

    • Ren, Yun-Lai; Tian, Xin-Zhe; Dong, Chuanhua; Zhao, Shuang; Wang, Jianji; Yan, Mengjie; Qi, Xiaoguang; Liu, Guihua Catalysis Communications, 2013 , vol. 32, p. 15 - 17
  • Route2
    • In-stock
      Bis(4-tert-butylphenyl)iodonium trifluoromethanesulfonate|CS-0085758
      84563-54-2
    • ~0%
    • null|null
      253185-03-4
    • In-stock
      1-(tert-Butyl)-4-iodobenzene|CS-W014070
      35779-04-5

    References

    • Tobisu, Mamoru; Furukawa, Takayuki; Chatani, Naoto Chemistry Letters, 2013 , vol. 42, # 10 p. 1203 - 1205
  • Route3

    References

    • Tetrahedron Letters, , vol. 26, # 40 p. 4955 - 4956

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   0
  • LogP   3.5887
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   0

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