28-Homodolicholide

Overview IFRA Request a quote

  • Identifiers

    CAS number
    86630-40-2

    Molecular formula
    C29H48O6

    SMILES
    C/C=C(/[C@H]([C@@H]([C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2COC(=O)[C@@H]4[C@@]3(C[C@H]([C@H](C4)O)O)C)C)O)O)\C(C)C

    Safety labels

  • Odor profile

    Fragrance
    Woody 54.92%
    Odorless 47.13%
    Mint 40.72%
    Cooling 39.79%
    Spicy 31.32%
    Amber 28.74%
    Balsamic 28.4%
    Herbal 26.81%
    Dry 25.79%
    Sandalwood 25.53%

     

    Flavor
    Bitter 54.94%
    Odorless 25.99%
    Herbal 24.27%
    Cedarleaf 23.0%
    Sweet-like 22.05%
    Bland 21.69%
    Green tea 20.64%
    Mentholic 20.42%
    Sandalwood 20.04%
    Minty 19.98%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    4.9

    pKa est.
    5.38 (weak acid)

    Molecular weight
    492.7 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    209°C

    Flash point

    • 239.78 ˚C est.

  • Synonyms

    • 28-Homodolicholide
    • 86630-40-2
    • DTXSID701317095
    • (3aS,5S,6R,7aR,7bS,9aS,10R,12aS,12bS)-10-[(2S,3R,4R,5E)-3,4-Dihydroxy-5-(propan-2-yl)hept-5-en-2-yl]-5,6-dihydroxy-7a,9a-dimethylhexadecahydro-3H-benzo[c]indeno[5,4-e]oxepin-3-one
    • 86630-40-2

  • Applications

    28-Homodolicholide is a polyisoprenoid lipid-related compound that can be viewed as a biochemical intermediate and analytical reference in glycosylation research and the synthesis of dolichol-derived lipids; it may be used as an intermediate for the preparation of dolichol-derived compounds and related lipids; it could be evaluated as a lipid-like component in cosmetic formulations with moisturizing properties; it can serve as an analytical reference standard in molecular biology and biochemistry work; and it could provide a basis for developing polymer or plastic formulations that incorporate lipid-like features. Its exact use will depend on local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 43.53
    methanol 151.05
    isopropanol 5.78
    water 0.53
    ethyl acetate 8.52
    n-propanol 14.42
    acetone 41.79
    n-butanol 5.41
    acetonitrile 2.99
    DMF 106.74
    toluene 5.62
    isobutanol 5.46
    1,4-dioxane 73.7
    methyl acetate 9.27
    THF 331.65
    2-butanone 14.84
    n-pentanol 8.01
    sec-butanol 2.82
    n-hexane 0.42
    ethylene glycol 14.51
    NMP 107.98
    cyclohexane 0.68
    DMSO 306.33
    n-butyl acetate 7.99
    n-octanol 5.56
    chloroform 9.83
    n-propyl acetate 6.93
    acetic acid 61.01
    dichloromethane 11.0
    cyclohexanone 32.88
    propylene glycol 10.75
    isopropyl acetate 7.05
    DMAc 75.05
    2-ethoxyethanol 51.58
    isopentanol 3.75
    n-heptane 0.45
    ethyl formate 10.06
    1,2-dichloroethane 8.3
    n-hexanol 9.33
    2-methoxyethanol 91.55
    isobutyl acetate 5.6
    tetrachloromethane 2.68
    n-pentyl acetate 12.06
    transcutol 65.19
    n-heptanol 8.99
    ethylbenzene 2.81
    MIBK 7.92
    2-propoxyethanol 63.63
    tert-butanol 3.6
    MTBE 3.48
    2-butoxyethanol 38.51
    propionic acid 13.7
    o-xylene 3.54
    formic acid 62.62
    diethyl ether 7.74
    m-xylene 3.86
    p-xylene 3.29
    chlorobenzene 5.61
    dimethyl carbonate 14.73
    n-octane 0.22
    formamide 51.98
    cyclopentanone 80.77
    2-pentanone 11.14
    anisole 9.13
    cyclopentyl methyl ether 24.68
    gamma-butyrolactone 78.63
    1-methoxy-2-propanol 35.64
    pyridine 32.22
    3-pentanone 8.75
    furfural 51.22
    n-dodecane 0.13
    diethylene glycol 60.03
    diisopropyl ether 1.73
    tert-amyl alcohol 2.38
    acetylacetone 26.24
    n-hexadecane 0.16
    acetophenone 12.38
    methyl propionate 11.82
    isopentyl acetate 7.89
    trichloroethylene 15.8
    n-nonanol 5.9
    cyclohexanol 4.7
    benzyl alcohol 13.7
    2-ethylhexanol 3.88
    isooctanol 6.34
    dipropyl ether 5.4
    1,2-dichlorobenzene 4.82
    ethyl lactate 8.53
    propylene carbonate 20.78
    n-methylformamide 47.39
    2-pentanol 2.06
    n-pentane 0.35
    1-propoxy-2-propanol 25.22
    1-methoxy-2-propyl acetate 20.59
    2-(2-methoxypropoxy) propanol 20.1
    mesitylene 2.24
    ε-caprolactone 28.34
    p-cymene 2.35
    epichlorohydrin 70.06
    1,1,1-trichloroethane 3.87
    2-aminoethanol 30.94
    morpholine-4-carbaldehyde 110.53
    sulfolane 118.3
    2,2,4-trimethylpentane 0.19
    2-methyltetrahydrofuran 33.05
    n-hexyl acetate 12.01
    isooctane 0.17
    2-(2-butoxyethoxy)ethanol 35.51
    sec-butyl acetate 4.35
    tert-butyl acetate 8.73
    decalin 0.45
    glycerin 29.32
    diglyme 60.58
    acrylic acid 20.99
    isopropyl myristate 3.4
    n-butyric acid 13.03
    acetyl acetate 10.05
    di(2-ethylhexyl) phthalate 8.47
    ethyl propionate 5.44
    nitromethane 51.56
    1,2-diethoxyethane 14.44
    benzonitrile 7.16
    trioctyl phosphate 5.64
    1-bromopropane 2.82
    gamma-valerolactone 133.0
    n-decanol 3.35
    triethyl phosphate 4.78
    4-methyl-2-pentanol 2.01
    propionitrile 3.12
    vinylene carbonate 22.28
    1,1,2-trichlorotrifluoroethane 47.47
    DMS 12.01
    cumene 2.06
    2-octanol 3.44
    2-hexanone 9.25
    octyl acetate 5.98
    limonene 3.0
    1,2-dimethoxyethane 53.5
    ethyl orthosilicate 4.66
    tributyl phosphate 4.27
    diacetone alcohol 13.77
    N,N-dimethylaniline 6.99
    acrylonitrile 5.84
    aniline 8.57
    1,3-propanediol 27.17
    bromobenzene 4.69
    dibromomethane 6.5
    1,1,2,2-tetrachloroethane 10.81
    2-methyl-cyclohexyl acetate 8.82
    tetrabutyl urea 7.28
    diisobutyl methanol 1.98
    2-phenylethanol 16.29
    styrene 3.11
    dioctyl adipate 8.0
    dimethyl sulfate 29.75
    ethyl butyrate 5.7
    methyl lactate 16.7
    butyl lactate 13.85
    diethyl carbonate 3.94
    propanediol butyl ether 29.45
    triethyl orthoformate 6.12
    p-tert-butyltoluene 2.26
    methyl 4-tert-butylbenzoate 18.28
    morpholine 77.37
    tert-butylamine 1.37
    n-dodecanol 1.88
    dimethoxymethane 86.68
    ethylene carbonate 16.77
    cyrene 36.14
    2-ethoxyethyl acetate 24.96
    2-ethylhexyl acetate 6.21
    1,2,4-trichlorobenzene 7.53
    4-methylpyridine 16.49
    dibutyl ether 2.78
    2,6-dimethyl-4-heptanol 1.98
    DEF 15.8
    dimethyl isosorbide 38.57
    tetrachloroethylene 11.69
    eugenol 21.6
    triacetin 16.52
    span 80 20.66
    1,4-butanediol 14.28
    1,1-dichloroethane 3.54
    2-methyl-1-pentanol 4.84
    methyl formate 39.6
    2-methyl-1-butanol 3.45
    n-decane 0.31
    butyronitrile 2.86
    3,7-dimethyl-1-octanol 3.61
    1-chlorooctane 1.63
    1-chlorotetradecane 0.49
    n-nonane 0.26
    undecane 0.19
    tert-butylcyclohexane 0.31
    cyclooctane 0.34
    cyclopentanol 11.32
    tetrahydropyran 26.93
    tert-amyl methyl ether 2.93
    2,5,8-trioxanonane 38.85
    1-hexene 1.39
    2-isopropoxyethanol 22.67
    2,2,2-trifluoroethanol 18.39
    methyl butyrate 7.41

    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