N-[1-(beta-D-Glucopyranosyloxy)-3,4-dihydroxynonadec-11-en-2-yl]-2-hydroxyicosanamide

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  • Identifiers

    CAS number
    230295-19-9

    Molecular formula
    C45H87NO10

    SMILES
    CCCCCCCCCCCCCCCCCCC(C(=O)NC(CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O)C(C(CCCCCCC=CCCCCCCC)O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Waxy 44.62%
    Odorless 40.42%
    Oily 37.07%
    Fatty 33.73%
    Savory 23.19%
    Citrus 22.07%
    Milky 21.93%
    Fresh 21.87%
    Woody 20.88%
    Sweet 20.7%

     

    Flavor
    Bland 37.58%
    Odorless 34.41%
    Mild 32.69%
    Waxy 27.04%
    Faint 24.47%
    Fatty 24.19%
    Slightly waxy 21.58%
    Delicate 20.65%
    Sweet-like 20.61%
    Bay oil 20.36%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    11.7

    pKa est.
    -2.62 (strong acid)

    Molecular weight
    802.2 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    3296°C

    Flash point

    • 216.63 ˚C est.

  • Synonyms

    • DTXSID901120529
    • N-[1-(beta-D-Glucopyranosyloxy)-3,4-dihydroxynonadec-11-en-2-yl]-2-hydroxyicosanamide
    • 230295-19-9
    • N-[1-[(I(2)-D-Glucopyranosyloxy)methyl]-2,3-dihydroxy-10-octadecen-1-yl]-2-hydroxyeicosanamide
    • 230295-19-9

  • Applications

    N-[1-(beta-D-Glucopyranosyloxy)-3,4-dihydroxynonadec-11-en-2-yl]-2-hydroxyicosanamide (CAS 230295-19-9) is a glycosylated long-chain lipid that is typically considered for cosmetics and personal care as an emollient and mild surfactant, for industrial chemical applications as a surfactant/emulsifier and processing aid in polymer and coating formulations, and as a gateway intermediate for the synthesis of glycosylated lipid derivatives used to develop specialized products. It may function as an emulsifier or surfactant in skin-care formulations and household cleaning products. Its glycolipid structure enables exploration as an intermediate for glycosylated lipid derivatives in research and development of new formulations, and it can contribute to dispersion stability and surface properties in polymer or coating systems.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3.39
    methanol 9.05
    isopropanol 2.05
    water 0.55
    ethyl acetate 5.21
    n-propanol 3.81
    acetone 8.13
    n-butanol 2.76
    acetonitrile 1.74
    DMF 27.58
    toluene 2.53
    isobutanol 2.34
    1,4-dioxane 11.29
    methyl acetate 5.42
    THF 25.62
    2-butanone 7.76
    n-pentanol 2.93
    sec-butanol 2.81
    n-hexane 0.31
    ethylene glycol 2.32
    NMP 75.15
    cyclohexane 0.65
    DMSO 48.85
    n-butyl acetate 3.03
    n-octanol 3.71
    chloroform 7.83
    n-propyl acetate 3.9
    acetic acid 22.85
    dichloromethane 7.36
    cyclohexanone 18.85
    propylene glycol 4.5
    isopropyl acetate 4.52
    DMAc 59.17
    2-ethoxyethanol 11.61
    isopentanol 2.08
    n-heptane 0.4
    ethyl formate 4.85
    1,2-dichloroethane 4.99
    n-hexanol 1.91
    2-methoxyethanol 15.1
    isobutyl acetate 2.59
    tetrachloromethane 2.24
    n-pentyl acetate 7.99
    transcutol 38.19
    n-heptanol 3.72
    ethylbenzene 1.68
    MIBK 4.07
    2-propoxyethanol 8.92
    tert-butanol 2.46
    MTBE 2.83
    2-butoxyethanol 12.83
    propionic acid 8.8
    o-xylene 2.9
    formic acid 15.38
    diethyl ether 2.49
    m-xylene 2.16
    p-xylene 1.87
    chlorobenzene 2.45
    dimethyl carbonate 8.43
    n-octane 0.33
    formamide 16.6
    cyclopentanone 26.02
    2-pentanone 6.41
    anisole 3.5
    cyclopentyl methyl ether 11.16
    gamma-butyrolactone 30.7
    1-methoxy-2-propanol 12.79
    pyridine 7.95
    3-pentanone 6.5
    furfural 23.3
    n-dodecane 0.22
    diethylene glycol 7.56
    diisopropyl ether 1.03
    tert-amyl alcohol 3.63
    acetylacetone 14.2
    n-hexadecane 0.25
    acetophenone 6.99
    methyl propionate 7.88
    isopentyl acetate 3.17
    trichloroethylene 11.14
    n-nonanol 3.94
    cyclohexanol 4.91
    benzyl alcohol 4.83
    2-ethylhexanol 1.62
    isooctanol 2.97
    dipropyl ether 2.56
    1,2-dichlorobenzene 3.2
    ethyl lactate 6.13
    propylene carbonate 15.0
    n-methylformamide 12.98
    2-pentanol 1.99
    n-pentane 0.3
    1-propoxy-2-propanol 7.54
    1-methoxy-2-propyl acetate 8.75
    2-(2-methoxypropoxy) propanol 12.15
    mesitylene 1.42
    ε-caprolactone 20.88
    p-cymene 1.3
    epichlorohydrin 18.67
    1,1,1-trichloroethane 4.62
    2-aminoethanol 4.83
    morpholine-4-carbaldehyde 43.98
    sulfolane 83.21
    2,2,4-trimethylpentane 0.29
    2-methyltetrahydrofuran 11.33
    n-hexyl acetate 8.12
    isooctane 0.13
    2-(2-butoxyethoxy)ethanol 16.53
    sec-butyl acetate 3.28
    tert-butyl acetate 6.34
    decalin 0.47
    glycerin 10.62
    diglyme 29.11
    acrylic acid 10.81
    isopropyl myristate 2.51
    n-butyric acid 9.92
    acetyl acetate 6.47
    di(2-ethylhexyl) phthalate 3.99
    ethyl propionate 4.17
    nitromethane 26.09
    1,2-diethoxyethane 7.42
    benzonitrile 2.9
    trioctyl phosphate 3.18
    1-bromopropane 2.06
    gamma-valerolactone 46.53
    n-decanol 2.42
    triethyl phosphate 3.65
    4-methyl-2-pentanol 1.31
    propionitrile 1.79
    vinylene carbonate 13.01
    1,1,2-trichlorotrifluoroethane 34.12
    DMS 7.66
    cumene 1.34
    2-octanol 2.72
    2-hexanone 4.7
    octyl acetate 4.22
    limonene 2.07
    1,2-dimethoxyethane 12.57
    ethyl orthosilicate 3.51
    tributyl phosphate 3.18
    diacetone alcohol 11.85
    N,N-dimethylaniline 4.38
    acrylonitrile 2.94
    aniline 4.25
    1,3-propanediol 6.04
    bromobenzene 2.21
    dibromomethane 3.93
    1,1,2,2-tetrachloroethane 12.37
    2-methyl-cyclohexyl acetate 4.58
    tetrabutyl urea 5.36
    diisobutyl methanol 1.06
    2-phenylethanol 3.62
    styrene 1.53
    dioctyl adipate 5.42
    dimethyl sulfate 25.97
    ethyl butyrate 3.55
    methyl lactate 13.5
    butyl lactate 10.99
    diethyl carbonate 2.27
    propanediol butyl ether 14.05
    triethyl orthoformate 4.25
    p-tert-butyltoluene 1.44
    methyl 4-tert-butylbenzoate 13.28
    morpholine 16.34
    tert-butylamine 1.14
    n-dodecanol 1.51
    dimethoxymethane 14.43
    ethylene carbonate 10.08
    cyrene 22.26
    2-ethoxyethyl acetate 13.85
    2-ethylhexyl acetate 2.7
    1,2,4-trichlorobenzene 5.16
    4-methylpyridine 6.51
    dibutyl ether 2.85
    2,6-dimethyl-4-heptanol 1.06
    DEF 13.08
    dimethyl isosorbide 20.13
    tetrachloroethylene 9.62
    eugenol 10.86
    triacetin 16.24
    span 80 12.69
    1,4-butanediol 3.4
    1,1-dichloroethane 3.34
    2-methyl-1-pentanol 2.65
    methyl formate 11.01
    2-methyl-1-butanol 2.65
    n-decane 0.48
    butyronitrile 1.59
    3,7-dimethyl-1-octanol 2.38
    1-chlorooctane 1.99
    1-chlorotetradecane 0.64
    n-nonane 0.41
    undecane 0.31
    tert-butylcyclohexane 0.33
    cyclooctane 0.39
    cyclopentanol 6.75
    tetrahydropyran 8.05
    tert-amyl methyl ether 3.91
    2,5,8-trioxanonane 19.13
    1-hexene 0.84
    2-isopropoxyethanol 7.72
    2,2,2-trifluoroethanol 14.49
    methyl butyrate 5.71

    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