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CS-W001157 4
Total: USD 88.00

1-Allyl-4-(tert-butyl)benzene

  • CAS No. 27798-45-4

  • Cat. No. CS-0267263
  • Molecule weight174.28
  • Purity≥95%
  • MDL No.None

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

1-Allyl-4-(tert-butyl)benzene|CS-0267263

Structure of 27798-45-4

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General Information

  • CAS No. 27798-45-4
  • Cat. No. CS-0267263
  • Purity ≥95%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₃H₁₈
  • Molecular Weight 174.28
  • Synonym(s) 3-(4-tert-Butylphenyl)-1-propene
  • SMILES C=CCC1=CC=C(C=C1)C(C)(C)C

Synthesis

  • Route1

    References

    • Gajare, Anil S.; Jensen, Rader S.; Toyota, Kozo; Yoshifuji, Masaaki; Ozawa, Fumiyuki Synlett, 2005 , # 1 art. no. U25204ST, p. 144 - 148
  • Route2

    References

    • Denmark, Scott E.; Werner, Nathan S. Journal of the American Chemical Society, 2008 , vol. 130, # 48 p. 16382 - 16393
  • Route3

    References

    • Seomoon, Dong; Phil, Ho Lee Journal of Organic Chemistry, 2008 , vol. 73, # 3 p. 1165 - 1168

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS02,GHS08
Signal Word : Danger
UN#: 3295
Class : 3
Packing Group : Ⅲ
Hazard Statements : H226-H304
Precautionary Statements : P210-P233-P240-P241-P242-P243-P280-P331-P370+P378-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   0
  • LogP   3.7126
  • H_Acceptors   0
  • H_Donors   0
  • Rotatable_Bonds   2

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