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CS-W001157 4
Total: USD 88.00

3,5-Di-tert-butyl-o-benzoquinone

  • CAS No. 3383-21-9

  • Cat. No. CS-0095759
  • Purity≥98%
  • MDL No.None

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

3,5-Di-tert-butyl-o-benzoquinone|CS-0095759

Structure of 3383-21-9

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General Information

  • CAS No. 3383-21-9
  • Cat. No. CS-0095759
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C, protect from light, stored under nitrogen
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₄H₂₀O₂
  • Molecular Weight 220.31
  • Synonym(s) 3,5-di-tert-butylcyclohexa-3,5-diene-1,2-dione
  • SMILES O=C(C(C(C)(C)C)=CC(C(C)(C)C)=C1)C1=O

Description

Reactions of the phosphinidene-bridged complexes [Fe2(5-C5H5)2(-PR)(-CO)(CO)2] (R = Cy, Ph) with 3,5-di-tert-butyl-o-benzoquinone has been reported.3,5-Di-tert-butyl-o-benzoquinone was used in the preparation of benzoxazoles derivative ligands. It was also used in the preparation of 1,4-benzodioxines via hetero Diels Alder reaction with acyclic dienes.

Synthesis

  • Route1

    References

    • Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), , p. 509 - 511
  • Route2

    References

    • Tetrahedron Letters, , vol. 23, # 9 p. 957 - 960
  • Route3
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    References

    • Journal of the American Chemical Society, , vol. 108, p. 2921

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

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Computational Chemistry Data

  • TPSA   34.14
  • LogP   3.0832
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   0

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