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CS-W001157 4
Total: USD 88.00

2-Cyclohexylpropane-1,3-diol

  • CAS No. 2612-32-0

  • Cat. No. CS-0437396
  • Molecule weight158.24
  • Purity≥98%
  • MDL No.None

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

2-Cyclohexylpropane-1,3-diol|CS-0437396

Structure of 2612-32-0

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General Information

  • CAS No. 2612-32-0
  • Cat. No. CS-0437396
  • Purity ≥98%
  • MDL No. None
  • Storage 4°C
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₉H₁₈O₂
  • Molecular Weight 158.24
  • Synonym(s) 2-Cyclohexyl-1,3-propanediol
  • SMILES OCC(C1CCCCC1)CO

Synthesis

  • Route1
    • Diethyl 2-cyclohexylmalonate|CS-0206334
      2163-44-2
    • ~99%
    • In-stock
      2-Cyclohexylpropane-1,3-diol|CS-0437396
      2612-32-0

    References

    • Fraley, Mark E.; Hoffman, William F.; Rubino, Robert S.; Hungate, Randall W.; Tebben, Andrew J.; Rutledge, Ruth Z.; McFall, Rosemary C.; Huckle, William R.; Kendall, Richard L.; Coll, Kathleen E.; Thomas, Kenneth A. Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 19 p. 2767 - 2770
  • Route2

    References

    • Rios-Lombardia, Nicolas; Busto, Eduardo; Garcia-Urdiales, Eduardo; Gotor-Fernandez, Vicente; Gotor, Vicente Journal of Organic Chemistry, 2009 , vol. 74, # 6 p. 2571 - 2574
  • Route3
    • Diethyl 2-(cyclohex-2-en-1-yl)malonate|CS-0967786
      6305-63-1
    • ~%
    • In-stock
      2-Cyclohexylpropane-1,3-diol|CS-0437396
      2612-32-0

    References

    • Fraley, Mark E.; Hoffman, William F.; Rubino, Robert S.; Hungate, Randall W.; Tebben, Andrew J.; Rutledge, Ruth Z.; McFall, Rosemary C.; Huckle, William R.; Kendall, Richard L.; Coll, Kathleen E.; Thomas, Kenneth A. Bioorganic and Medicinal Chemistry Letters, 2002 , vol. 12, # 19 p. 2767 - 2770

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H315-H319-H335
Precautionary Statements : P261-P264-P271-P280-P302+P352-P362-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   40.46
  • LogP   1.1675
  • H_Acceptors   2
  • H_Donors   2
  • Rotatable_Bonds   3

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