Sorbitan, tritetradecanoate

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  • Identifiers

    CAS number
    80032-90-2

    Molecular formula
    C48H90O8

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

    Safety labels

  • Odor profile

    Fragrance
    Waxy 64.33%
    Fatty 57.75%
    Oily 45.58%
    Odorless 40.12%
    Creamy 23.99%
    Milky 21.79%
    Buttery 21.73%
    Dairy 19.52%
    Sweet 18.9%
    Alcoholic 18.83%

     

    Flavor
    Waxy 45.54%
    Fatty 44.62%
    Bland 40.95%
    Mild 40.84%
    Oily 38.65%
    Odorless 31.46%
    Faint 30.35%
    Fat 24.53%
    Slightly waxy 24.17%
    Bay oil 23.01%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    17.8

    pKa est.
    8.54 (weak base)

    Molecular weight
    795.2 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    680°C

    Flash point

    • 246.31 ˚C est.

  • Synonyms

    • Sorbitan, tritetradecanoate
    • 80032-90-2
    • EINECS 279-373-9
    • RefChem:184452
    • 279-373-9
    • Sorbitan tritetradecanoate
    • SCHEMBL2702052
    • MTHNXRAYKHQOHR-UBNRVJQBSA-N
    • 80032-90-2

  • Applications

    Sorbitan, tritetradecanoate (CAS 80032-90-2) is a nonionic surfactant/emulsifier derived from sorbitan and tetradecanoic acid. In practice it is used as an emulsifier and stabilizer in cosmetics and personal care formulations (creams, lotions, oil–water emulsions); it is employed in food processing as an emulsifier and texture/stability aid for oil–water systems; in household and cleaning products as a surfactant to improve cleaning efficacy and pigment dispersion; in coatings and inks as a dispersing/emulsifying additive for pigments and binders; and in pharmaceutical formulations as a solubilizer and emulsifier to enhance drug dispersion and compatibility.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 55.72
    methanol 66.95
    isopropanol 65.73
    water 3.45
    ethyl acetate 604.12
    n-propanol 98.2
    acetone 431.94
    n-butanol 86.59
    acetonitrile 192.88
    DMF 698.24
    toluene 169.73
    isobutanol 84.55
    1,4-dioxane 350.95
    methyl acetate 536.42
    THF 742.56
    2-butanone 502.55
    n-pentanol 89.38
    sec-butanol 119.51
    n-hexane 22.58
    ethylene glycol 18.9
    NMP 1867.43
    cyclohexane 52.98
    DMSO 745.44
    n-butyl acetate 307.29
    n-octanol 85.94
    chloroform 948.29
    n-propyl acetate 404.98
    acetic acid 569.98
    dichloromethane 1015.22
    cyclohexanone 902.42
    propylene glycol 38.35
    isopropyl acetate 458.73
    DMAc 1650.63
    2-ethoxyethanol 220.87
    isopentanol 86.65
    n-heptane 17.24
    ethyl formate 315.15
    1,2-dichloroethane 608.57
    n-hexanol 64.16
    2-methoxyethanol 220.46
    isobutyl acetate 216.39
    tetrachloromethane 245.95
    n-pentyl acetate 478.98
    transcutol 619.7
    n-heptanol 78.73
    ethylbenzene 98.88
    MIBK 256.85
    2-propoxyethanol 187.08
    tert-butanol 96.31
    MTBE 188.55
    2-butoxyethanol 238.47
    propionic acid 387.54
    o-xylene 163.38
    formic acid 154.45
    diethyl ether 174.51
    m-xylene 115.52
    p-xylene 142.4
    chlorobenzene 339.1
    dimethyl carbonate 420.42
    n-octane 12.42
    formamide 262.37
    cyclopentanone 1117.49
    2-pentanone 411.94
    anisole 204.92
    cyclopentyl methyl ether 424.66
    gamma-butyrolactone 1593.62
    1-methoxy-2-propanol 229.6
    pyridine 504.34
    3-pentanone 459.55
    furfural 975.05
    n-dodecane 7.8
    diethylene glycol 88.84
    diisopropyl ether 82.26
    tert-amyl alcohol 162.97
    acetylacetone 769.4
    n-hexadecane 9.14
    acetophenone 383.06
    methyl propionate 608.02
    isopentyl acetate 274.89
    trichloroethylene 1344.78
    n-nonanol 88.13
    cyclohexanol 183.97
    benzyl alcohol 154.33
    2-ethylhexanol 64.13
    isooctanol 76.41
    dipropyl ether 118.5
    1,2-dichlorobenzene 424.5
    ethyl lactate 238.95
    propylene carbonate 991.49
    n-methylformamide 362.15
    2-pentanol 93.12
    n-pentane 18.17
    1-propoxy-2-propanol 182.16
    1-methoxy-2-propyl acetate 386.74
    2-(2-methoxypropoxy) propanol 217.39
    mesitylene 78.58
    ε-caprolactone 1078.18
    p-cymene 69.16
    epichlorohydrin 1072.1
    1,1,1-trichloroethane 872.56
    2-aminoethanol 49.16
    morpholine-4-carbaldehyde 967.13
    sulfolane 2130.57
    2,2,4-trimethylpentane 21.09
    2-methyltetrahydrofuran 619.86
    n-hexyl acetate 423.64
    isooctane 8.38
    2-(2-butoxyethoxy)ethanol 254.83
    sec-butyl acetate 318.53
    tert-butyl acetate 445.53
    decalin 29.66
    glycerin 73.09
    diglyme 580.22
    acrylic acid 390.82
    isopropyl myristate 122.85
    n-butyric acid 521.88
    acetyl acetate 636.33
    di(2-ethylhexyl) phthalate 136.56
    ethyl propionate 440.4
    nitromethane 1134.26
    1,2-diethoxyethane 270.19
    benzonitrile 219.46
    trioctyl phosphate 99.83
    1-bromopropane 287.0
    gamma-valerolactone 1378.6
    n-decanol 54.24
    triethyl phosphate 223.21
    4-methyl-2-pentanol 57.43
    propionitrile 182.71
    vinylene carbonate 878.03
    1,1,2-trichlorotrifluoroethane 878.54
    DMS 475.6
    cumene 68.62
    2-octanol 73.13
    2-hexanone 296.41
    octyl acetate 185.3
    limonene 111.39
    1,2-dimethoxyethane 346.55
    ethyl orthosilicate 187.56
    tributyl phosphate 138.22
    diacetone alcohol 357.15
    N,N-dimethylaniline 158.77
    acrylonitrile 254.63
    aniline 198.01
    1,3-propanediol 81.49
    bromobenzene 392.23
    dibromomethane 575.85
    1,1,2,2-tetrachloroethane 1103.29
    2-methyl-cyclohexyl acetate 241.71
    tetrabutyl urea 187.91
    diisobutyl methanol 40.49
    2-phenylethanol 114.89
    styrene 120.12
    dioctyl adipate 235.96
    dimethyl sulfate 1002.94
    ethyl butyrate 308.15
    methyl lactate 339.8
    butyl lactate 329.59
    diethyl carbonate 222.98
    propanediol butyl ether 182.32
    triethyl orthoformate 240.0
    p-tert-butyltoluene 63.71
    methyl 4-tert-butylbenzoate 414.49
    morpholine 445.04
    tert-butylamine 55.4
    n-dodecanol 36.65
    dimethoxymethane 381.92
    ethylene carbonate 762.23
    cyrene 343.69
    2-ethoxyethyl acetate 627.87
    2-ethylhexyl acetate 238.22
    1,2,4-trichlorobenzene 597.79
    4-methylpyridine 481.36
    dibutyl ether 137.37
    2,6-dimethyl-4-heptanol 40.49
    DEF 624.42
    dimethyl isosorbide 445.83
    tetrachloroethylene 681.13
    eugenol 273.61
    triacetin 697.19
    span 80 197.1
    1,4-butanediol 50.01
    1,1-dichloroethane 569.81
    2-methyl-1-pentanol 102.66
    methyl formate 334.58
    2-methyl-1-butanol 108.89
    n-decane 17.43
    butyronitrile 150.12
    3,7-dimethyl-1-octanol 76.31
    1-chlorooctane 90.52
    1-chlorotetradecane 29.47
    n-nonane 15.82
    undecane 10.78
    tert-butylcyclohexane 21.15
    cyclooctane 21.82
    cyclopentanol 239.94
    tetrahydropyran 394.38
    tert-amyl methyl ether 230.31
    2,5,8-trioxanonane 333.75
    1-hexene 65.8
    2-isopropoxyethanol 178.86
    2,2,2-trifluoroethanol 421.61
    methyl butyrate 527.14

    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