Digalloyl Trioleate

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  • Identifiers

    CAS number
    17048-39-4

    Molecular formula
    C68H106O12

    SMILES
    CCCCCCCC/C=C\CCCCCCCC(=O)OC1=CC(=CC(=C1OC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCCCC)C(=O)OC2=CC(=CC(=C2O)O)C(=O)O

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  • Odor profile

    Fragrance
    Waxy 53.24%
    Fatty 49.51%
    Odorless 42.85%
    Oily 37.91%
    Balsamic 29.85%
    Milky 20.73%
    Sweet 19.52%
    Dairy 19.09%
    Creamy 18.45%
    Woody 17.57%

     

    Flavor
    Bland 34.07%
    Faint 33.12%
    Mild 31.59%
    Odorless 29.8%
    Fatty 28.68%
    Waxy 27.31%
    Oily 24.55%
    Slightly waxy 22.47%
    Bay oil 20.72%
    Delicate 20.24%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    23.8

    pKa est.
    3.14 (weak acid)

    Molecular weight
    1115.6 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    1198°C

    Flash point

    • 255.18 ˚C est.

  • Synonyms

    • DIGALLOYL TRIOLEATE
    • 17048-39-4
    • Digalloyl trioleate [USAN]
    • PGQ9BY2MDE
    • UNII-PGQ9BY2MDE
    • Gallic acid, 3-gallate, trioleate
    • Digalloyl trioleate (USAN)
    • Oleic acid, triester with gallic acid, 3-ester with gallic acid
    • DTXSID601009857
    • RefChem:133617
    • DIGALLOYL TRIOLEATE [INCI]
    • DTXCID401436294
    • 3,4-dihydroxy-5-[3,4,5-tris[[(Z)-octadec-9-enoyl]oxy]benzoyl]oxybenzoic acid
    • SCHEMBL29373316
    • D08905
    • Q27286548
    • 3,4-Dihydroxy-5-[(3,4,5-tris{[(9Z)-octadec-9-enoyl]oxy}benzoyl)oxy]benzoic acid
    • 17048-39-4

  • Applications

    Digalloyl trioleate is used primarily as a polyphenolic antioxidant and stabilizer in polymer and coating formulations, helping protect plastics, paints, and inks from oxidative degradation and color fading; it can function as a processing stabilizer for olefin polymers and as a metal-chelating additive to improve aging resistance; in cosmetics and personal care, it may act as an antioxidant and stabilizer in oil-rich formulations; in household products and cleaners it can serve to extend product shelf life by inhibiting oxidation; and it is also employed as an intermediate in organic synthesis for gallic ester derivatives.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 16.08
    methanol 19.07
    isopropanol 20.03
    water 0.26
    ethyl acetate 82.87
    n-propanol 26.08
    acetone 99.92
    n-butanol 18.33
    acetonitrile 27.63
    DMF 178.63
    toluene 34.73
    isobutanol 19.28
    1,4-dioxane 76.91
    methyl acetate 109.65
    THF 206.89
    2-butanone 117.8
    n-pentanol 20.6
    sec-butanol 32.21
    n-hexane 4.23
    ethylene glycol 5.82
    NMP 396.06
    cyclohexane 5.66
    DMSO 242.36
    n-butyl acetate 39.59
    n-octanol 12.68
    chloroform 133.52
    n-propyl acetate 55.51
    acetic acid 123.25
    dichloromethane 122.11
    cyclohexanone 145.68
    propylene glycol 17.25
    isopropyl acetate 58.26
    DMAc 412.19
    2-ethoxyethanol 53.53
    isopentanol 15.21
    n-heptane 2.61
    ethyl formate 44.95
    1,2-dichloroethane 80.23
    n-hexanol 11.87
    2-methoxyethanol 54.73
    isobutyl acetate 27.39
    tetrachloromethane 32.64
    n-pentyl acetate 51.73
    transcutol 96.68
    n-heptanol 12.47
    ethylbenzene 19.35
    MIBK 34.97
    2-propoxyethanol 42.97
    tert-butanol 27.1
    MTBE 43.33
    2-butoxyethanol 38.84
    propionic acid 82.82
    o-xylene 30.85
    formic acid 33.24
    diethyl ether 34.11
    m-xylene 21.97
    p-xylene 26.03
    chlorobenzene 40.03
    dimethyl carbonate 82.66
    n-octane 1.99
    formamide 53.88
    cyclopentanone 222.25
    2-pentanone 73.3
    anisole 37.49
    cyclopentyl methyl ether 76.63
    gamma-butyrolactone 270.44
    1-methoxy-2-propanol 60.02
    pyridine 92.68
    3-pentanone 84.25
    furfural 135.14
    n-dodecane 1.24
    diethylene glycol 22.63
    diisopropyl ether 12.88
    tert-amyl alcohol 41.93
    acetylacetone 126.7
    n-hexadecane 1.46
    acetophenone 59.62
    methyl propionate 105.33
    isopentyl acetate 31.02
    trichloroethylene 185.26
    n-nonanol 13.42
    cyclohexanol 32.53
    benzyl alcohol 32.21
    2-ethylhexanol 9.95
    isooctanol 10.46
    dipropyl ether 21.38
    1,2-dichlorobenzene 44.1
    ethyl lactate 40.55
    propylene carbonate 121.28
    n-methylformamide 75.27
    2-pentanol 19.23
    n-pentane 3.39
    1-propoxy-2-propanol 39.05
    1-methoxy-2-propyl acetate 60.31
    2-(2-methoxypropoxy) propanol 43.26
    mesitylene 12.17
    ε-caprolactone 153.44
    p-cymene 9.61
    epichlorohydrin 182.16
    1,1,1-trichloroethane 115.22
    2-aminoethanol 15.82
    morpholine-4-carbaldehyde 186.04
    sulfolane 431.23
    2,2,4-trimethylpentane 3.26
    2-methyltetrahydrofuran 113.2
    n-hexyl acetate 49.42
    isooctane 1.18
    2-(2-butoxyethoxy)ethanol 44.73
    sec-butyl acetate 42.14
    tert-butyl acetate 57.61
    decalin 3.88
    glycerin 25.21
    diglyme 90.82
    acrylic acid 83.25
    isopropyl myristate 16.04
    n-butyric acid 76.17
    acetyl acetate 75.88
    di(2-ethylhexyl) phthalate 19.23
    ethyl propionate 62.21
    nitromethane 213.46
    1,2-diethoxyethane 43.84
    benzonitrile 27.4
    trioctyl phosphate 15.13
    1-bromopropane 45.04
    gamma-valerolactone 250.24
    n-decanol 8.92
    triethyl phosphate 27.09
    4-methyl-2-pentanol 10.47
    propionitrile 29.64
    vinylene carbonate 99.92
    1,1,2-trichlorotrifluoroethane 174.71
    DMS 71.44
    cumene 12.07
    2-octanol 11.92
    2-hexanone 55.09
    octyl acetate 24.08
    limonene 13.92
    1,2-dimethoxyethane 77.76
    ethyl orthosilicate 23.16
    tributyl phosphate 18.84
    diacetone alcohol 66.25
    N,N-dimethylaniline 32.11
    acrylonitrile 40.58
    aniline 39.65
    1,3-propanediol 20.54
    bromobenzene 42.36
    dibromomethane 73.3
    1,1,2,2-tetrachloroethane 162.9
    2-methyl-cyclohexyl acetate 31.49
    tetrabutyl urea 28.66
    diisobutyl methanol 6.71
    2-phenylethanol 21.43
    styrene 21.36
    dioctyl adipate 30.91
    dimethyl sulfate 190.08
    ethyl butyrate 37.56
    methyl lactate 71.3
    butyl lactate 43.86
    diethyl carbonate 27.86
    propanediol butyl ether 35.79
    triethyl orthoformate 31.35
    p-tert-butyltoluene 9.66
    methyl 4-tert-butylbenzoate 60.78
    morpholine 98.0
    tert-butylamine 13.23
    n-dodecanol 6.35
    dimethoxymethane 95.12
    ethylene carbonate 83.09
    cyrene 72.6
    2-ethoxyethyl acetate 80.02
    2-ethylhexyl acetate 27.14
    1,2,4-trichlorobenzene 69.43
    4-methylpyridine 78.82
    dibutyl ether 18.26
    2,6-dimethyl-4-heptanol 6.71
    DEF 103.88
    dimethyl isosorbide 72.44
    tetrachloroethylene 94.77
    eugenol 40.46
    triacetin 90.02
    span 80 39.85
    1,4-butanediol 13.53
    1,1-dichloroethane 87.8
    2-methyl-1-pentanol 19.56
    methyl formate 68.88
    2-methyl-1-butanol 20.95
    n-decane 2.51
    butyronitrile 21.22
    3,7-dimethyl-1-octanol 10.6
    1-chlorooctane 10.99
    1-chlorotetradecane 4.13
    n-nonane 2.27
    undecane 1.66
    tert-butylcyclohexane 3.09
    cyclooctane 2.68
    cyclopentanol 50.25
    tetrahydropyran 73.25
    tert-amyl methyl ether 45.2
    2,5,8-trioxanonane 59.52
    1-hexene 13.06
    2-isopropoxyethanol 41.41
    2,2,2-trifluoroethanol 71.4
    methyl butyrate 71.98

    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