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CS-W001157 4
Total: USD 88.00

2,5-Di-tert-pentylcyclohexa-2,5-diene-1,4-dione

  • CAS No. 4584-63-8

  • Cat. No. CS-0186514
  • Purity≥95%
  • MDL No.None

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

2,5-Di-tert-pentylcyclohexa-2,5-diene-1,4-dione|CS-0186514

Structure of 4584-63-8

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General Information

  • CAS No. 4584-63-8
  • Cat. No. CS-0186514
  • Purity ≥95%
  • MDL No. None
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₆H₂₄O₂
  • Molecular Weight 248.36
  • Synonym(s) 2,5-Di-tert-pentyl-1,4-benzoquinone
  • SMILES CCC(C)(C)C1=CC(=O)C(=CC1=O)C(C)(C)CC

Synthesis

  • Route1
    • 2,5-Di-tert-pentylbenzene-1,4-diol|CS-0319422
      79-74-3
    • ~80%
    • In-stock
      2,5-Di-tert-pentylcyclohexa-2,5-diene-1,4-dione|CS-0186514
      4584-63-8

    References

    • Ishii, Fumio; Kishi, Ken-ichi Synthesis, 1980 , # 9 p. 706 - 708
  • Route2
    • null|null
      123-31-9
    • ~%
    • In-stock
      2,5-Di-tert-pentylcyclohexa-2,5-diene-1,4-dione|CS-0186514
      4584-63-8

    References

    • Koenigs; Mai Chemische Berichte, 1892 , vol. 25, p. 2650
  • Route3
    • null|null
      64-17-5
    • 2,5-Di-tert-pentylbenzene-1,4-diol|CS-0319422
      79-74-3
    • null|null
      7705-08-0
    • ~%
    • In-stock
      2,5-Di-tert-pentylcyclohexa-2,5-diene-1,4-dione|CS-0186514
      4584-63-8

    References

    • Koenigs; Mai Chemische Berichte, 1892 , vol. 25, p. 2650

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   34.14
  • LogP   3.8634
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   4

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