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CS-W001157 4
Total: USD 88.00

((1S,4r)-4-pentylcyclohexyl)methanol

  • CAS No. 71458-08-7

  • Cat. No. CS-0491682
  • Purity≥98%
  • MDL No.MFCD12031858

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

((1S,4r)-4-pentylcyclohexyl)methanol|CS-0491682

Structure of 71458-08-7

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General Information

  • CAS No. 71458-08-7
  • Cat. No. CS-0491682
  • Purity ≥98%
  • MDL No. MFCD12031858
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₂H₂₄O
  • Molecular Weight 184.32
  • Synonym(s) (4-Pentylcyclohexyl)methanol
  • SMILES CCCCC[C@H]1CC[C@H](CO)CC1

Synthesis

  • Route1

    References

    • Hoffmann-La Roche Inc. Patent: US4550981 A1, 1985 ;
  • Route2
    • null|null
      80361-70-2
    • ~93%
    • ((1S,4r)-4-pentylcyclohexyl)methanol|CS-0491682
      71458-08-7

    References

    • Szostak, Michal; Spain, Malcolm; Eberhart, Andrew J.; Procter, David J. Journal of the American Chemical Society, 2014 , vol. 136, # 6 p. 2268 - 2271
  • Route3
    • null|null
      67589-90-6
    • ~90%
    • ((1S,4r)-4-pentylcyclohexyl)methanol|CS-0491682
      71458-08-7

    References

    • Carr; Gray; McDonnell Molecular crystals and liquid crystals, 1982 , vol. 97, # 1-4 p. 13 - 28

Safety Information

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GHS Pictogram : N/A
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Hazard Statements : N/A
Precautionary Statements : N/A

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Computational Chemistry Data

  • TPSA   20.23
  • LogP   3.3654
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   5

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