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CS-W001157 4
Total: USD 88.00

3-[(2-Methylpropan-2-yl)oxy]benzaldehyde

  • CAS No. 64859-36-5

  • Cat. No. CS-0038890
  • Purity≥97%
  • MDL No.None

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

3-[(2-Methylpropan-2-yl)oxy]benzaldehyde|CS-0038890

Structure of 64859-36-5

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General Information

  • CAS No. 64859-36-5
  • Cat. No. CS-0038890
  • Purity ≥97%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₄O₂
  • Molecular Weight 178.23
  • Synonym(s) 3-Tert-Butoxybenzaldehyde(WXC03810)
  • SMILES CC(C)(C)OC1=CC=CC(=C1)C=O

Synthesis

  • Route1

    References

    • Durley, Richard C.; Grapperhaus, Margaret L.; Hickory, Brian S.; Massa, Mark A.; Wang, Jane L.; Spangler, Dale P.; Mischke, Deborah A.; Parnas, Barry L.; Fobian, Yvette M.; Rath, Nigam P.; Honda, Dorothy D.; Zeng, Ming; Connolly, Daniel T.; Heuvelman, Deborah M.; Witherbee, Bryan J.; Melton, Michele A.; Glenn, Kevin C.; Krul, Elaine S.; Smith, Mark E.; Sikorski, James A. Journal of Medicinal Chemistry, 2002 , vol. 45, # 18 p. 3891 - 3904
  • Route2
    • [3-(tert-butoxy)phenyl]methanol|CS-0248268
      64859-35-4
    • ~%
    • 3-[(2-Methylpropan-2-yl)oxy]benzaldehyde|CS-0038890
      64859-36-5

    References

    • Kostikov,R.R. et al. Zhurnal Organicheskoi Khimii, 1977 , vol. 13, # 9 p. 1857 - 1871,1721 - 1733
  • Route3
    • null|null
      15359-97-4
    • ~%
    • 3-[(2-Methylpropan-2-yl)oxy]benzaldehyde|CS-0038890
      64859-36-5

    References

    • Kostikov,R.R. et al. Zhurnal Organicheskoi Khimii, 1977 , vol. 13, # 9 p. 1857 - 1871,1721 - 1733

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   26.3
  • LogP   2.6764
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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