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CS-W001157 4
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5-Methyl-2-(propan-2-yl)cyclohexane-1-carboxylic acid

  • CAS No. 39668-86-5

  • Cat. No. CS-0243749
  • Molecule weight184.28
  • Purity95+%
  • MDL No.None

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

5-Methyl-2-(propan-2-yl)cyclohexane-1-carboxylic acid|CS-0243749

Structure of 39668-86-5

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General Information

  • CAS No. 39668-86-5
  • Cat. No. CS-0243749
  • Purity 95+%
  • MDL No. None
  • Storage Sealed in dry,2-8℃
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₂₀O₂
  • Molecular Weight 184.28
  • Synonym(s) p-Menthane-3-carboxylic acid
  • SMILES CC(C)C1CCC(C)CC1C(=O)O

Synthesis

  • Route1
    • TRPM8 agonist WS-3, 99%|CS-1269069
      39711-79-0
    • ~61%
    • 5-Methyl-2-(propan-2-yl)cyclohexane-1-carboxylic acid|CS-0243749
      39668-86-5

    References

    • Dendreon Corporation Patent: US2007/232603 A1, 2007 ; Location in patent: Page/Page column 15 ;
  • Route2
    • null|null
      124-38-9
    • null|null
      28953-96-0
    • ~%
    • 5-Methyl-2-(propan-2-yl)cyclohexane-1-carboxylic acid|CS-0243749
      39668-86-5

    References

    • Millennium Specialty Chemicals, Inc. Patent: US2010/168470 A1, 2010 ; Location in patent: Page/Page column 4 ;
  • Route3
    • null|null
      65560-17-0
    • ~%
    • 5-Methyl-2-(propan-2-yl)cyclohexane-1-carboxylic acid|CS-0243749
      39668-86-5

    References

    • Kagawa,M. Chemical and Pharmaceutical Bulletin, 1961 , vol. 9, p. 391 - 403

Safety Information

Download SDS
GHS Pictogram : N/A
GHS No : N/A
Signal Word : N/A
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : N/A
Precautionary Statements : N/A

Quality Control

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Computational Chemistry Data

  • TPSA   37.3
  • LogP   2.7794
  • H_Acceptors   1
  • H_Donors   1
  • Rotatable_Bonds   2

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