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CS-W001157 4
Total: USD 88.00

4-Isopropoxycyclohexanone

  • CAS No. 69697-46-7

  • Cat. No. CS-0084760
  • Molecule weight156.22
  • Purity≥97%
  • MDL No.MFCD16658578

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

4-Isopropoxycyclohexanone|CS-0084760

Structure of 69697-46-7

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General Information

  • CAS No. 69697-46-7
  • Cat. No. CS-0084760
  • Purity ≥97%
  • MDL No. MFCD16658578
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₆O₂
  • Molecular Weight 156.22
  • Synonym(s) 4-propan-2-yloxycyclohexan-1-one
  • SMILES O=C1CCC(OC(C)C)CC1

Synthesis

  • Route1
    • 8-Isopropoxy-1,4-dioxaspiro[4.5]decane|CS-0733981
      950771-91-2
    • ~99%
    • 4-Isopropoxycyclohexanone|CS-0084760
      69697-46-7

    References

    • GLAXO GROUP LIMITED Patent: WO2007/107566 A1, 2007 ; Location in patent: Page/Page column 66 ; WO 2007/107566 A1
  • Route2
    • In-stock
      1,4-Dioxaspiro[4.5]decan-8-ol|CS-W007474
      22428-87-1
    • null|null
      75-30-9
    • ~0%
    • 8-Isopropoxy-1,4-dioxaspiro[4.5]decane|CS-0733981
      950771-91-2
    • 4-Isopropoxycyclohexanone|CS-0084760
      69697-46-7

    References

    • GLAXO GROUP LIMITED Patent: WO2007/107565 A1, 2007 ; Location in patent: Page/Page column 60-61 ; WO 2007/107565 A1
  • Route3

    References

    • AC Immune, S.A. Patent: US2011/280808 A1, 2011 ;

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-H332-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   1.9231
  • H_Acceptors   2
  • H_Donors   0
  • Rotatable_Bonds   2

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