Glyuranolide

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  • Identifiers

    CAS number
    123914-44-3

    Molecular formula
    C31H44O6

    SMILES
    C[C@]12CC[C@@H](C([C@@H]1CC[C@@]3([C@@H]2C(=O)C=C4[C@]3(CC[C@@]5([C@H]4C[C@]6(C[C@@H]5OC6=O)C)C)C(=O)OC)C)(C)C)O

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  • Odor profile

    Fragrance
    Woody 68.1%
    Cedar 44.21%
    Amber 38.31%
    Spicy 37.99%
    Camphoreous 37.96%
    Herbal 34.68%
    Dry 33.92%
    Tobacco 32.86%
    Mint 31.98%
    Pine 30.51%

     

    Flavor
    Bitter 83.35%
    Cedarleaf 23.71%
    Camphor 23.54%
    Ripe apricot 22.99%
    Red fruit 22.49%
    Patchouli 21.15%
    Parsley 21.01%
    Lovage 20.83%
    Pine 20.78%
    Fir 20.51%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    4.7

    pKa est.
    5.57 (weak acid)

    Molecular weight
    512.7 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    131°C

    Flash point

    • 249.43 ˚C est.

  • Synonyms

    • Glyuranolide
    • RefChem:922394
    • Olean-12-ene-27,29-dioic acid, 3,22-dihydroxy-11-oxo-, gamma-lactone, methyl ester, (3beta,20alpha,22alpha)-
    • 123914-44-3
    • 3,22-Dihydroxy-11-oxo-delta(12)-oleanene-27-alpha-methoxycarbonyl-29-oic acid
    • 123914-44-3

  • Applications

    Glyuranolide (CAS 123914-44-3) is primarily used as an intermediate in organic synthesis and may function as a solvent or processing aid in coatings, inks, and cleaning formulations. It can serve as a plasticizer or polymer modifier in certain plastics and polymer systems, helping adjust flexibility and processing characteristics. In cosmetics and personal care, it may be employed as a solvent or formulation component within controlled products, subject to regulatory limits. It is also evaluated as a chemical intermediate in pharmaceutical and agrochemical research to enable synthesis of more complex compounds, again with formulation and regulatory considerations.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 98.13
    methanol 98.22
    isopropanol 104.81
    water 0.07
    ethyl acetate 71.98
    n-propanol 138.93
    acetone 121.75
    n-butanol 100.69
    acetonitrile 57.43
    DMF 555.72
    toluene 48.48
    isobutanol 76.15
    1,4-dioxane 200.81
    methyl acetate 72.53
    THF 411.91
    2-butanone 105.29
    n-pentanol 55.01
    sec-butanol 51.99
    n-hexane 1.28
    ethylene glycol 24.81
    NMP 338.16
    cyclohexane 2.12
    DMSO 215.04
    n-butyl acetate 35.31
    n-octanol 12.67
    chloroform 183.79
    n-propyl acetate 33.97
    acetic acid 167.4
    dichloromethane 111.89
    cyclohexanone 158.26
    propylene glycol 46.05
    isopropyl acetate 49.54
    DMAc 275.14
    2-ethoxyethanol 124.09
    isopentanol 50.87
    n-heptane 0.81
    ethyl formate 55.09
    1,2-dichloroethane 69.8
    n-hexanol 45.83
    2-methoxyethanol 260.91
    isobutyl acetate 23.93
    tetrachloromethane 23.18
    n-pentyl acetate 35.44
    transcutol 109.14
    n-heptanol 23.56
    ethylbenzene 13.4
    MIBK 44.9
    2-propoxyethanol 195.95
    tert-butanol 48.41
    MTBE 25.98
    2-butoxyethanol 84.19
    propionic acid 86.16
    o-xylene 18.64
    formic acid 68.75
    diethyl ether 59.29
    m-xylene 22.84
    p-xylene 15.12
    chlorobenzene 53.64
    dimethyl carbonate 83.63
    n-octane 0.34
    formamide 97.4
    cyclopentanone 260.56
    2-pentanone 94.12
    anisole 37.7
    cyclopentyl methyl ether 95.34
    gamma-butyrolactone 286.83
    1-methoxy-2-propanol 240.37
    pyridine 180.75
    3-pentanone 67.31
    furfural 185.57
    n-dodecane 0.22
    diethylene glycol 123.37
    diisopropyl ether 9.61
    tert-amyl alcohol 27.34
    acetylacetone 101.87
    n-hexadecane 0.28
    acetophenone 47.08
    methyl propionate 105.93
    isopentyl acetate 31.1
    trichloroethylene 181.56
    n-nonanol 14.04
    cyclohexanol 45.47
    benzyl alcohol 56.08
    2-ethylhexanol 15.15
    isooctanol 15.97
    dipropyl ether 19.84
    1,2-dichlorobenzene 42.35
    ethyl lactate 32.27
    propylene carbonate 99.04
    n-methylformamide 222.62
    2-pentanol 39.01
    n-pentane 1.88
    1-propoxy-2-propanol 93.95
    1-methoxy-2-propyl acetate 75.07
    2-(2-methoxypropoxy) propanol 41.97
    mesitylene 9.37
    ε-caprolactone 134.96
    p-cymene 6.52
    epichlorohydrin 285.53
    1,1,1-trichloroethane 62.17
    2-aminoethanol 74.09
    morpholine-4-carbaldehyde 368.38
    sulfolane 270.21
    2,2,4-trimethylpentane 0.73
    2-methyltetrahydrofuran 115.9
    n-hexyl acetate 35.18
    isooctane 0.65
    2-(2-butoxyethoxy)ethanol 65.09
    sec-butyl acetate 21.91
    tert-butyl acetate 39.68
    decalin 1.09
    glycerin 79.51
    diglyme 115.52
    acrylic acid 96.6
    isopropyl myristate 9.28
    n-butyric acid 119.21
    acetyl acetate 54.3
    di(2-ethylhexyl) phthalate 19.0
    ethyl propionate 33.85
    nitromethane 222.35
    1,2-diethoxyethane 34.06
    benzonitrile 51.79
    trioctyl phosphate 12.6
    1-bromopropane 37.65
    gamma-valerolactone 404.26
    n-decanol 7.69
    triethyl phosphate 13.18
    4-methyl-2-pentanol 18.63
    propionitrile 66.64
    vinylene carbonate 113.79
    1,1,2-trichlorotrifluoroethane 190.67
    DMS 42.26
    cumene 7.11
    2-octanol 10.14
    2-hexanone 41.4
    octyl acetate 15.11
    limonene 8.44
    1,2-dimethoxyethane 123.67
    ethyl orthosilicate 12.61
    tributyl phosphate 11.8
    diacetone alcohol 63.72
    N,N-dimethylaniline 25.62
    acrylonitrile 96.73
    aniline 75.39
    1,3-propanediol 129.32
    bromobenzene 47.54
    dibromomethane 69.33
    1,1,2,2-tetrachloroethane 128.31
    2-methyl-cyclohexyl acetate 23.05
    tetrabutyl urea 17.84
    diisobutyl methanol 6.92
    2-phenylethanol 56.98
    styrene 17.68
    dioctyl adipate 18.99
    dimethyl sulfate 120.74
    ethyl butyrate 23.48
    methyl lactate 86.92
    butyl lactate 39.12
    diethyl carbonate 15.65
    propanediol butyl ether 60.71
    triethyl orthoformate 19.97
    p-tert-butyltoluene 6.55
    methyl 4-tert-butylbenzoate 43.48
    morpholine 301.18
    tert-butylamine 17.88
    n-dodecanol 4.23
    dimethoxymethane 296.78
    ethylene carbonate 91.6
    cyrene 77.78
    2-ethoxyethyl acetate 63.69
    2-ethylhexyl acetate 22.75
    1,2,4-trichlorobenzene 63.7
    4-methylpyridine 137.95
    dibutyl ether 8.14
    2,6-dimethyl-4-heptanol 6.92
    DEF 117.61
    dimethyl isosorbide 79.42
    tetrachloroethylene 86.22
    eugenol 47.4
    triacetin 43.15
    span 80 42.71
    1,4-butanediol 44.67
    1,1-dichloroethane 71.74
    2-methyl-1-pentanol 29.32
    methyl formate 133.18
    2-methyl-1-butanol 48.73
    n-decane 0.58
    butyronitrile 56.57
    3,7-dimethyl-1-octanol 10.48
    1-chlorooctane 4.4
    1-chlorotetradecane 1.14
    n-nonane 0.46
    undecane 0.34
    tert-butylcyclohexane 0.87
    cyclooctane 0.74
    cyclopentanol 82.61
    tetrahydropyran 127.78
    tert-amyl methyl ether 19.56
    2,5,8-trioxanonane 62.67
    1-hexene 7.68
    2-isopropoxyethanol 66.35
    2,2,2-trifluoroethanol 68.58
    methyl butyrate 42.15

    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