Doristerol

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  • Identifiers

    CAS number
    566-99-4

    Molecular formula
    C27H46O

    SMILES
    C[C@H](CCCC(C)C)[C@H]1CCC2=C3CC[C@H]4C[C@H](CC[C@@]4([C@H]3CC[C@]12C)C)O

    Safety labels

  • Odor profile

    Fragrance
    Woody 83.04%
    Sandalwood 52.5%
    Amber 47.2%
    Balsamic 42.79%
    Dry 42.31%
    Waxy 40.05%
    Sweet 35.24%
    Spicy 34.53%
    Vetiver 33.48%
    Cedar 32.82%

     

    Flavor
    Woody 43.38%
    Wood 35.77%
    Spice 31.25%
    Herb 28.53%
    Waxy 26.64%
    Pine 24.64%
    Fir needle 24.09%
    Balsam 22.97%
    Sandalwood 22.29%
    Mild 22.19%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    8.0

    pKa est.
    8.45 (weak base)

    Molecular weight
    386.7 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    500°C

    Melting point expt.

    • 120 °C

    Flash point

    • 206.8 ˚C est.

  • Synonyms

    • Doristerol
    • 566-99-4
    • Delta8(14)-Cholestenol
    • (3S,5S,9R,10S,13R,17R)-10,13-dimethyl-17-[(2R)-6-methylheptan-2-yl]-2,3,4,5,6,7,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-ol
    • Cholest-8(14)-en-3beta-ol
    • 5alpha-Cholest-8(14)-en-3beta-ol
    • (3beta,5alpha)-Cholest-8(14)-en-3-ol; 5alpha-Cholest-8(14)-ene-3beta-ol
    • LMST01010097
    • TPL64BMT8B
    • SCHEMBL4303282
    • 5a-cholest-8(14)-en-3b-ol
    • CHEBI:166793
    • DTXSID901312065
    • 5alpha-Cholest-8(14)-ene-3beta-ol
    • (3beta,5alpha)-Cholest-8(14)-en-3-ol
    • 5I+/--Cholest-8(14)-en-3I(2)-ol
    • Cholest-8(14)-en-3-ol, (3beta,5alpha)-
    • (3S,5S,9S,10R,13S,17R)-10,13-DIMETHYL-17-((2R)-6-METHYLHEPTAN-2-YL)-2,3,4,5,6,7,9,11,12,15,16,17-DODECAHYDRO-1H-CYCLOPENTA(A)PHENANTHREN-3-OL
    • 566-99-4

  • Applications

    Doristerol (CAS 566-99-4) has multiple practical applications across several industries: in cosmetics/personal care as a skin-conditioning emollient; commonly evaluated as an intermediate in steroid synthesis for pharmaceutical applications; used as an additive in polymers/plastics where it can function as a stabilizer and/or plasticizer or processing aid; and may serve as a wax-like component or rheology modifier in coatings and inks to improve surface properties.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 41.5
    methanol 8.17
    isopropanol 39.25
    water 0.09
    ethyl acetate 54.92
    n-propanol 51.37
    acetone 66.6
    n-butanol 65.78
    acetonitrile 10.38
    DMF 34.14
    toluene 117.45
    isobutanol 39.84
    1,4-dioxane 143.43
    methyl acetate 28.03
    THF 275.44
    2-butanone 59.99
    n-pentanol 30.26
    sec-butanol 19.13
    n-hexane 4.44
    ethylene glycol 1.01
    NMP 44.43
    cyclohexane 12.44
    DMSO 15.79
    n-butyl acetate 78.48
    n-octanol 24.09
    chloroform 135.69
    n-propyl acetate 42.69
    acetic acid 13.41
    dichloromethane 87.83
    cyclohexanone 117.27
    propylene glycol 2.54
    isopropyl acetate 75.83
    DMAc 54.24
    2-ethoxyethanol 38.95
    isopentanol 63.62
    n-heptane 7.61
    ethyl formate 16.44
    1,2-dichloroethane 59.48
    n-hexanol 50.31
    2-methoxyethanol 46.83
    isobutyl acetate 53.37
    tetrachloromethane 26.3
    n-pentyl acetate 74.27
    transcutol 285.39
    n-heptanol 38.61
    ethylbenzene 34.17
    MIBK 77.83
    2-propoxyethanol 109.25
    tert-butanol 34.31
    MTBE 61.2
    2-butoxyethanol 85.73
    propionic acid 13.58
    o-xylene 48.6
    formic acid 2.61
    diethyl ether 96.2
    m-xylene 74.45
    p-xylene 39.54
    chlorobenzene 70.83
    dimethyl carbonate 18.7
    n-octane 2.14
    formamide 4.59
    cyclopentanone 109.92
    2-pentanone 81.66
    anisole 68.07
    cyclopentyl methyl ether 101.0
    gamma-butyrolactone 73.83
    1-methoxy-2-propanol 56.43
    pyridine 106.73
    3-pentanone 52.25
    furfural 59.37
    n-dodecane 1.25
    diethylene glycol 30.43
    diisopropyl ether 34.69
    tert-amyl alcohol 17.91
    acetylacetone 87.08
    n-hexadecane 1.56
    acetophenone 56.07
    methyl propionate 40.28
    isopentyl acetate 103.15
    trichloroethylene 108.07
    n-nonanol 28.92
    cyclohexanol 39.11
    benzyl alcohol 39.2
    2-ethylhexanol 39.83
    isooctanol 36.99
    dipropyl ether 72.77
    1,2-dichlorobenzene 60.74
    ethyl lactate 18.37
    propylene carbonate 43.23
    n-methylformamide 10.34
    2-pentanol 32.38
    n-pentane 6.94
    1-propoxy-2-propanol 93.59
    1-methoxy-2-propyl acetate 126.29
    2-(2-methoxypropoxy) propanol 70.33
    mesitylene 42.56
    ε-caprolactone 93.25
    p-cymene 34.47
    epichlorohydrin 103.79
    1,1,1-trichloroethane 61.9
    2-aminoethanol 5.42
    morpholine-4-carbaldehyde 78.15
    sulfolane 54.18
    2,2,4-trimethylpentane 3.6
    2-methyltetrahydrofuran 110.64
    n-hexyl acetate 75.01
    isooctane 4.58
    2-(2-butoxyethoxy)ethanol 106.49
    sec-butyl acetate 45.38
    tert-butyl acetate 89.99
    decalin 6.09
    glycerin 5.54
    diglyme 196.46
    acrylic acid 8.87
    isopropyl myristate 32.22
    n-butyric acid 49.71
    acetyl acetate 43.41
    di(2-ethylhexyl) phthalate 33.89
    ethyl propionate 39.3
    nitromethane 20.45
    1,2-diethoxyethane 110.82
    benzonitrile 41.44
    trioctyl phosphate 23.03
    1-bromopropane 49.43
    gamma-valerolactone 162.47
    n-decanol 18.88
    triethyl phosphate 32.36
    4-methyl-2-pentanol 33.73
    propionitrile 24.36
    vinylene carbonate 39.53
    1,1,2-trichlorotrifluoroethane 42.62
    DMS 41.29
    cumene 25.64
    2-octanol 20.63
    2-hexanone 46.29
    octyl acetate 35.94
    limonene 37.88
    1,2-dimethoxyethane 96.57
    ethyl orthosilicate 39.33
    tributyl phosphate 24.28
    diacetone alcohol 64.14
    N,N-dimethylaniline 45.99
    acrylonitrile 17.77
    aniline 65.06
    1,3-propanediol 23.89
    bromobenzene 84.06
    dibromomethane 66.88
    1,1,2,2-tetrachloroethane 84.71
    2-methyl-cyclohexyl acetate 63.96
    tetrabutyl urea 33.67
    diisobutyl methanol 31.23
    2-phenylethanol 67.65
    styrene 39.04
    dioctyl adipate 45.56
    dimethyl sulfate 21.68
    ethyl butyrate 65.32
    methyl lactate 15.81
    butyl lactate 50.08
    diethyl carbonate 38.15
    propanediol butyl ether 41.78
    triethyl orthoformate 65.7
    p-tert-butyltoluene 33.26
    methyl 4-tert-butylbenzoate 78.1
    morpholine 137.86
    tert-butylamine 26.51
    n-dodecanol 12.59
    dimethoxymethane 90.05
    ethylene carbonate 39.56
    cyrene 50.27
    2-ethoxyethyl acetate 111.96
    2-ethylhexyl acetate 81.66
    1,2,4-trichlorobenzene 70.9
    4-methylpyridine 104.78
    dibutyl ether 39.18
    2,6-dimethyl-4-heptanol 31.23
    DEF 52.65
    dimethyl isosorbide 118.34
    tetrachloroethylene 59.43
    eugenol 70.44
    triacetin 72.12
    span 80 55.63
    1,4-butanediol 6.53
    1,1-dichloroethane 55.51
    2-methyl-1-pentanol 32.39
    methyl formate 7.76
    2-methyl-1-butanol 44.32
    n-decane 3.3
    butyronitrile 39.12
    3,7-dimethyl-1-octanol 31.96
    1-chlorooctane 16.68
    1-chlorotetradecane 5.1
    n-nonane 2.68
    undecane 1.9
    tert-butylcyclohexane 5.29
    cyclooctane 4.82
    cyclopentanol 27.17
    tetrahydropyran 167.81
    tert-amyl methyl ether 34.13
    2,5,8-trioxanonane 109.8
    1-hexene 16.05
    2-isopropoxyethanol 39.83
    2,2,2-trifluoroethanol 6.4
    methyl butyrate 43.03

    Scent© AI

1 4

IFRA standard 51

Recommendation
No restriction
Maximum acceptable concentrations in the finished product (%)
Category 1
Products applied to the lips
 No restriction Category 7A
Rinse-off products applied to the hair with some hand contact
 No restriction
Category 2
Products applied to the axillae
 No restriction Category 7B
Leave-on products applied to the hair with some hand contact
 No restriction
Category 3
Products applied to the face/body using fingertips
 No restriction Category 8
Products with significant anogenital exposure
 No restriction
Category 4
Products related to fine fragrance
 No restriction Category 9
Products with body and hand exposure, primarily rinse off
 No restriction
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
 No restriction Category 10A
Household care products with mostly hand contact
 No restriction
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
 No restriction Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
 No restriction
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
 No restriction Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
 No restriction
Category 5D
Baby Creams, baby Oils and baby talc
 No restriction Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
 No restriction
Category 6
Products with oral and lip exposure
 No restriction Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
 No restriction