CID 86278328

Overview IFRA Request a quote

  • Identifiers

    CAS number
    168677-75-6

    Molecular formula
    C30H60ClNO6

    SMILES
    CCCCC/C=C\C/C=C\CCCCCCCC[N+](CCCOCCO)(CCOCCO)CC(CO)O.[Cl-]

  • Odor profile

    Fragrance
    Waxy 42.27%
    Oily 36.4%
    Fatty 35.36%
    Odorless 31.34%
    Fresh 27.55%
    Sweet 26.69%
    Fruity 25.09%
    Fishy 22.95%
    Alcoholic 20.61%
    Citrus 20.18%

     

    Flavor
    Waxy 31.83%
    Mild 31.68%
    Bland 26.34%
    Fatty 25.23%
    Odorless 23.89%
    Faint 23.44%
    Delicate 21.41%
    Slightly waxy 21.15%
    Bay oil 20.44%
    Leathery 19.93%

     

    Odor impact est.
    Low

  • Properties

    pKa est.
    5.54 (weak acid)

    Molecular weight
    566.3 g/mol

    Flash point

    • 107.01 ˚C est.

  • Synonyms

    • 168677-75-6
    • 2,3-dihydroxypropyl-[2-(2-hydroxyethoxy)ethyl]-[3-(2-hydroxyethoxy)propyl]-[(9Z,12Z)-octadeca-9,12-dienyl]azanium;chloride
    • IBBTWBUZVVGGOQ-NBTZWHCOSA-M

  • Applications

    CID 86278328 (CAS 168677-75-6) is an organic compound primarily used as an intermediate in chemical synthesis and may function as a solvent or carrier in industrial processing; it is employed as an additive and stabilizer in plastics and polymers; it serves as a component in coatings and inks, acting as a solvent carrier or matrix; it also participates in industrial cleaning formulations as a solvent and cleaning aid; and it is evaluated for electronics or adhesives applications at the experimental level, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 13.02
    methanol 31.84
    isopropanol 5.65
    water 1.81
    ethyl acetate 11.3
    n-propanol 11.49
    acetone 18.5
    n-butanol 9.31
    acetonitrile 5.32
    DMF 47.3
    toluene 6.4
    isobutanol 7.81
    1,4-dioxane 25.4
    methyl acetate 10.74
    THF 48.86
    2-butanone 16.11
    n-pentanol 8.39
    sec-butanol 7.7
    n-hexane 0.85
    ethylene glycol 7.04
    NMP 111.38
    cyclohexane 3.47
    DMSO 125.34
    n-butyl acetate 7.63
    n-octanol 10.29
    chloroform 28.85
    n-propyl acetate 9.73
    acetic acid 55.65
    dichloromethane 29.8
    cyclohexanone 47.14
    propylene glycol 9.57
    isopropyl acetate 9.81
    DMAc 92.18
    2-ethoxyethanol 28.1
    isopentanol 8.07
    n-heptane 1.47
    ethyl formate 13.02
    1,2-dichloroethane 20.31
    n-hexanol 6.98
    2-methoxyethanol 37.5
    isobutyl acetate 7.0
    tetrachloromethane 8.26
    n-pentyl acetate 17.52
    transcutol 92.41
    n-heptanol 11.36
    ethylbenzene 4.37
    MIBK 10.95
    2-propoxyethanol 22.55
    tert-butanol 7.38
    MTBE 6.35
    2-butoxyethanol 31.84
    propionic acid 20.42
    o-xylene 7.39
    formic acid 39.44
    diethyl ether 5.72
    m-xylene 5.7
    p-xylene 4.43
    chlorobenzene 7.32
    dimethyl carbonate 14.48
    n-octane 0.99
    formamide 39.98
    cyclopentanone 51.91
    2-pentanone 13.71
    anisole 8.91
    cyclopentyl methyl ether 24.87
    gamma-butyrolactone 54.61
    1-methoxy-2-propanol 27.14
    pyridine 21.61
    3-pentanone 14.06
    furfural 48.43
    n-dodecane 0.73
    diethylene glycol 20.3
    diisopropyl ether 2.61
    tert-amyl alcohol 9.88
    acetylacetone 26.52
    n-hexadecane 0.8
    acetophenone 17.63
    methyl propionate 15.44
    isopentyl acetate 9.17
    trichloroethylene 38.3
    n-nonanol 10.47
    cyclohexanol 17.97
    benzyl alcohol 13.78
    2-ethylhexanol 6.1
    isooctanol 10.1
    dipropyl ether 6.89
    1,2-dichlorobenzene 9.65
    ethyl lactate 14.85
    propylene carbonate 28.16
    n-methylformamide 25.23
    2-pentanol 5.8
    n-pentane 0.95
    1-propoxy-2-propanol 18.32
    1-methoxy-2-propyl acetate 18.49
    2-(2-methoxypropoxy) propanol 26.71
    mesitylene 3.95
    ε-caprolactone 46.45
    p-cymene 4.28
    epichlorohydrin 44.87
    1,1,1-trichloroethane 15.22
    2-aminoethanol 13.85
    morpholine-4-carbaldehyde 70.37
    sulfolane 137.26
    2,2,4-trimethylpentane 1.19
    2-methyltetrahydrofuran 25.85
    n-hexyl acetate 18.32
    isooctane 0.5
    2-(2-butoxyethoxy)ethanol 38.25
    sec-butyl acetate 8.12
    tert-butyl acetate 14.11
    decalin 1.92
    glycerin 22.96
    diglyme 68.45
    acrylic acid 22.29
    isopropyl myristate 6.3
    n-butyric acid 26.87
    acetyl acetate 14.54
    di(2-ethylhexyl) phthalate 10.84
    ethyl propionate 9.69
    nitromethane 49.17
    1,2-diethoxyethane 15.67
    benzonitrile 8.87
    trioctyl phosphate 8.52
    1-bromopropane 7.61
    gamma-valerolactone 83.55
    n-decanol 6.76
    triethyl phosphate 10.92
    4-methyl-2-pentanol 4.66
    propionitrile 4.78
    vinylene carbonate 27.66
    1,1,2-trichlorotrifluoroethane 75.72
    DMS 14.08
    cumene 3.8
    2-octanol 6.97
    2-hexanone 10.94
    octyl acetate 9.98
    limonene 7.4
    1,2-dimethoxyethane 31.27
    ethyl orthosilicate 10.68
    tributyl phosphate 8.66
    diacetone alcohol 25.97
    N,N-dimethylaniline 10.05
    acrylonitrile 7.42
    aniline 11.34
    1,3-propanediol 16.26
    bromobenzene 6.73
    dibromomethane 16.52
    1,1,2,2-tetrachloroethane 39.83
    2-methyl-cyclohexyl acetate 14.99
    tetrabutyl urea 13.59
    diisobutyl methanol 4.14
    2-phenylethanol 11.02
    styrene 4.19
    dioctyl adipate 15.23
    dimethyl sulfate 41.23
    ethyl butyrate 10.09
    methyl lactate 23.44
    butyl lactate 22.86
    diethyl carbonate 7.07
    propanediol butyl ether 29.49
    triethyl orthoformate 12.24
    p-tert-butyltoluene 4.2
    methyl 4-tert-butylbenzoate 27.97
    morpholine 37.01
    tert-butylamine 3.7
    n-dodecanol 4.59
    dimethoxymethane 28.47
    ethylene carbonate 22.89
    cyrene 44.12
    2-ethoxyethyl acetate 26.17
    2-ethylhexyl acetate 7.91
    1,2,4-trichlorobenzene 14.08
    4-methylpyridine 14.68
    dibutyl ether 7.04
    2,6-dimethyl-4-heptanol 4.14
    DEF 27.47
    dimethyl isosorbide 44.27
    tetrachloroethylene 32.93
    eugenol 24.38
    triacetin 33.32
    span 80 27.51
    1,4-butanediol 9.08
    1,1-dichloroethane 11.31
    2-methyl-1-pentanol 8.85
    methyl formate 20.24
    2-methyl-1-butanol 9.88
    n-decane 1.43
    butyronitrile 5.05
    3,7-dimethyl-1-octanol 7.39
    1-chlorooctane 5.64
    1-chlorotetradecane 1.98
    n-nonane 1.27
    undecane 0.96
    tert-butylcyclohexane 1.24
    cyclooctane 1.63
    cyclopentanol 17.96
    tetrahydropyran 23.13
    tert-amyl methyl ether 9.33
    2,5,8-trioxanonane 46.66
    1-hexene 2.12
    2-isopropoxyethanol 17.59
    2,2,2-trifluoroethanol 31.75
    methyl butyrate 13.99

    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