Sorbitan, ditetradecanoate

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  • Identifiers

    CAS number
    97889-88-8

    Molecular formula
    C34H64O7

    SMILES
    CCCCCCCCCCCCCC(=O)O[C@@H]1[C@H](COC1[C@@H](CO)OC(=O)CCCCCCCCCCCCC)O

    Safety labels

  • Odor profile

    Fragrance
    Waxy 61.63%
    Fatty 55.03%
    Oily 44.77%
    Odorless 40.64%
    Creamy 24.15%
    Milky 23.94%
    Buttery 23.31%
    Lactonic 21.4%
    Dairy 20.55%
    Peach 20.54%

     

    Flavor
    Waxy 44.18%
    Fatty 43.37%
    Bland 40.05%
    Mild 39.51%
    Oily 37.2%
    Odorless 32.17%
    Faint 27.88%
    Slightly waxy 23.82%
    Fat 23.08%
    Bay oil 22.96%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    11.0

    pKa est.
    7.67 (neutral)

    Molecular weight
    584.9 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    778°C

    Flash point

    • 231.53 ˚C est.

  • Synonyms

    • Sorbitan, ditetradecanoate
    • 97889-88-8
    • EINECS 308-166-9
    • DTXSID90243328
    • RefChem:184434
    • DTXCID90165819
    • 308-166-9
    • RKLSGCIAVPVQQG-BXYXKYKCSA-N
    • (4xi)-1,4-Anhydro-3,5-di-O-tetradecanoyl-D-xylo-hexitol
    • 97889-88-8

  • Applications

    Sorbitan, ditetradecanoate (CAS 97889-88-8) is a nonionic surfactant and emulsifier derived from sorbitan with two myristate groups. It is commonly used as an emulsifier and stabilizer for oil-in-water systems in cosmetics and personal care, and it also functions as a surfactant and processing aid in household cleaning formulations. In industrial manufacturing, it supports pigment dispersion and emulsion stability in polymers, paints, and coatings. Depending on regulatory frameworks, it may be used as an emulsifier in food processing and as an excipient in pharmaceutical formulations, subject to local limits and formulation conditions.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 32.71
    methanol 48.63
    isopropanol 32.73
    water 3.19
    ethyl acetate 274.32
    n-propanol 50.07
    acetone 220.09
    n-butanol 45.29
    acetonitrile 91.82
    DMF 397.64
    toluene 77.09
    isobutanol 42.21
    1,4-dioxane 186.9
    methyl acetate 233.3
    THF 435.48
    2-butanone 238.81
    n-pentanol 46.11
    sec-butanol 58.4
    n-hexane 9.22
    ethylene glycol 11.43
    NMP 1115.75
    cyclohexane 26.82
    DMSO 527.03
    n-butyl acetate 150.2
    n-octanol 54.26
    chloroform 465.4
    n-propyl acetate 202.96
    acetic acid 309.24
    dichloromethane 529.63
    cyclohexanone 512.68
    propylene glycol 21.46
    isopropyl acetate 220.89
    DMAc 963.77
    2-ethoxyethanol 134.22
    isopentanol 47.05
    n-heptane 8.29
    ethyl formate 153.29
    1,2-dichloroethane 316.54
    n-hexanol 33.94
    2-methoxyethanol 135.17
    isobutyl acetate 111.28
    tetrachloromethane 118.35
    n-pentyl acetate 277.86
    transcutol 427.23
    n-heptanol 50.98
    ethylbenzene 48.95
    MIBK 132.75
    2-propoxyethanol 106.27
    tert-butanol 52.17
    MTBE 92.56
    2-butoxyethanol 162.28
    propionic acid 195.15
    o-xylene 80.34
    formic acid 101.64
    diethyl ether 81.98
    m-xylene 55.41
    p-xylene 69.14
    chlorobenzene 150.73
    dimethyl carbonate 195.79
    n-octane 6.52
    formamide 170.34
    cyclopentanone 617.62
    2-pentanone 204.54
    anisole 105.69
    cyclopentyl methyl ether 234.65
    gamma-butyrolactone 836.48
    1-methoxy-2-propanol 135.57
    pyridine 254.25
    3-pentanone 220.1
    furfural 533.58
    n-dodecane 4.2
    diethylene glycol 56.41
    diisopropyl ether 39.82
    tert-amyl alcohol 83.63
    acetylacetone 381.35
    n-hexadecane 4.94
    acetophenone 201.33
    methyl propionate 280.15
    isopentyl acetate 143.76
    trichloroethylene 683.62
    n-nonanol 56.12
    cyclohexanol 104.69
    benzyl alcohol 84.47
    2-ethylhexanol 36.05
    isooctanol 48.64
    dipropyl ether 63.86
    1,2-dichlorobenzene 195.63
    ethyl lactate 128.55
    propylene carbonate 518.67
    n-methylformamide 197.85
    2-pentanol 45.95
    n-pentane 7.57
    1-propoxy-2-propanol 107.34
    1-methoxy-2-propyl acetate 204.62
    2-(2-methoxypropoxy) propanol 136.04
    mesitylene 38.06
    ε-caprolactone 585.39
    p-cymene 35.43
    epichlorohydrin 567.79
    1,1,1-trichloroethane 410.55
    2-aminoethanol 30.16
    morpholine-4-carbaldehyde 572.3
    sulfolane 1286.05
    2,2,4-trimethylpentane 10.23
    2-methyltetrahydrofuran 325.46
    n-hexyl acetate 242.37
    isooctane 4.04
    2-(2-butoxyethoxy)ethanol 172.35
    sec-butyl acetate 156.6
    tert-butyl acetate 231.31
    decalin 15.77
    glycerin 44.91
    diglyme 400.34
    acrylic acid 188.46
    isopropyl myristate 67.97
    n-butyric acid 276.69
    acetyl acetate 281.58
    di(2-ethylhexyl) phthalate 76.99
    ethyl propionate 212.95
    nitromethane 594.58
    1,2-diethoxyethane 158.6
    benzonitrile 111.64
    trioctyl phosphate 57.88
    1-bromopropane 128.03
    gamma-valerolactone 790.86
    n-decanol 33.86
    triethyl phosphate 122.63
    4-methyl-2-pentanol 30.49
    propionitrile 81.46
    vinylene carbonate 433.79
    1,1,2-trichlorotrifluoroethane 513.07
    DMS 221.52
    cumene 36.3
    2-octanol 45.46
    2-hexanone 151.55
    octyl acetate 103.76
    limonene 58.66
    1,2-dimethoxyethane 213.22
    ethyl orthosilicate 106.6
    tributyl phosphate 78.36
    diacetone alcohol 209.29
    N,N-dimethylaniline 89.45
    acrylonitrile 115.64
    aniline 97.47
    1,3-propanediol 48.31
    bromobenzene 166.24
    dibromomethane 283.75
    1,1,2,2-tetrachloroethane 583.29
    2-methyl-cyclohexyl acetate 134.57
    tetrabutyl urea 109.38
    diisobutyl methanol 23.87
    2-phenylethanol 62.89
    styrene 57.77
    dioctyl adipate 134.67
    dimethyl sulfate 517.43
    ethyl butyrate 156.98
    methyl lactate 175.66
    butyl lactate 203.74
    diethyl carbonate 112.92
    propanediol butyl ether 121.56
    triethyl orthoformate 131.19
    p-tert-butyltoluene 33.71
    methyl 4-tert-butylbenzoate 242.56
    morpholine 251.86
    tert-butylamine 29.22
    n-dodecanol 22.4
    dimethoxymethane 211.74
    ethylene carbonate 388.9
    cyrene 207.37
    2-ethoxyethyl acetate 347.34
    2-ethylhexyl acetate 122.91
    1,2,4-trichlorobenzene 273.61
    4-methylpyridine 225.57
    dibutyl ether 78.62
    2,6-dimethyl-4-heptanol 23.87
    DEF 336.93
    dimethyl isosorbide 290.08
    tetrachloroethylene 378.53
    eugenol 168.24
    triacetin 382.12
    span 80 123.18
    1,4-butanediol 29.17
    1,1-dichloroethane 257.84
    2-methyl-1-pentanol 54.06
    methyl formate 180.75
    2-methyl-1-butanol 57.04
    n-decane 9.71
    butyronitrile 70.41
    3,7-dimethyl-1-octanol 47.23
    1-chlorooctane 50.89
    1-chlorotetradecane 15.9
    n-nonane 8.82
    undecane 5.88
    tert-butylcyclohexane 10.97
    cyclooctane 10.52
    cyclopentanol 130.33
    tetrahydropyran 213.61
    tert-amyl methyl ether 116.47
    2,5,8-trioxanonane 225.98
    1-hexene 27.36
    2-isopropoxyethanol 104.57
    2,2,2-trifluoroethanol 234.99
    methyl butyrate 277.41

    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