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  • 3,3,5-Trimethylcyclohexanol

  • 3,3,5-Trimethylcyclohexanol

    Catalog Number
    ACMA00016798
    Product Name
    3,3,5-Trimethylcyclohexanol
    Category
    Polymers
    Description
    Liquid; OtherSolid;PelletsLargeCrystals;Solid;Solid;Colourless crystals; menthol-like camphorous odour
    IUPAC Name
    3,3,5-trimethylcyclohexan-1-ol
    Molecular Weight
    142.24g/mol
    Molecular Formula
    C9H18O
    Canonical SMILES
    CC1CC(CC(C1)(C)C)O
    InChI
    InChI=1S/C9H18O/c1-7-4-8(10)6-9(2,3)5-7/h7-8,10H,4-6H2,1-3H3
    InChI Key
    BRRVXFOKWJKTGG-UHFFFAOYSA-N
    Boiling Point
    195.6 °C;198 °C
    Melting Point
    46.55 °C;37.0 °C
    Flash Point
    165 °F OC
    Density
    0.878 @ 40 °C/20 °C
    Solubility
    SLIGHTLY SOL IN WATER;Insoluble in water; soluble in oils;Soluble at room temperature (in ethanol)
    Application
    3,3,5-Trimethylcyclohexanol serves a versatile role in various industries due to its unique properties as a secondary alcohol. This white crystalline compound is primarily recognized for its efficacy as a menthol and camphor substitute. Being soluble in most organic solvents, hydrocarbons, and oils, but insoluble in water, it is suited for diverse applications such as an antifoaming agent, component in hydraulic fluids, and a key ingredient in textile soaps. Additionally, it is instrumental in odor masking and functions as an esterification agent. In pharmaceuticals, it exhibits inhibitory activity against HMG-CoA reductase, offering potential therapeutic implications. The compound is also utilized as an additive in waxes and printing inks, highlighting its adaptability and usefulness across multiple domains.
    Color/Form
    LIQ
    Complexity
    118
    Covalently-Bonded Unit Count
    1
    EC Number
    213-268-0;212-183-6;204-122-7
    Exact Mass
    142.135765g/mol
    Formal Charge
    0
    Heavy Atom Count
    10
    MeSH Entry Terms
    3,3,5-trimethylcyclohexanol;3,3,5-trimethylcyclohexanol, (cis)-isomer;3,3,5-trimethylcyclohexanol, (trans)-isomer;cis-3,3,5-trimethylcyclohexanol
    Monoisotopic Mass
    142.135765g/mol
    NSC Number
    4008
    Rotatable Bond Count
    0
    UNII
    08CL3G94GH
    Vapor Density
    4.9 (AIR= 1)
    Vapor Pressure
    0.1 MM HG @ 20 °C
    XLogP3
    2.6
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