N-[3-(dimethylamino)propyl]docosanamide;2-hydroxypropanoic acid

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  • Identifiers

    CAS number
    221446-54-4

    Molecular formula
    C30H62N2O4

    SMILES
    CCCCCCCCCCCCCCCCCCCCCC(=O)NCCCN(C)C.CC(C(=O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Waxy 47.55%
    Fishy 39.75%
    Fatty 35.17%
    Meaty 35.03%
    Savory 32.08%
    Odorless 29.33%
    Animal 29.24%
    Oily 27.28%
    Cheesy 25.01%
    Cooling 21.95%

     

    Flavor
    Bland 37.74%
    Mild 31.02%
    Faint 27.77%
    Odorless 27.28%
    Waxy 24.76%
    Fatty 24.21%
    Slightly waxy 22.66%
    Delicate 21.71%
    Bay oil 20.73%
    Beer 19.82%

     

    Odor impact est.
    Low

  • Properties

    pKa est.
    8.92 (weak base)

    Molecular weight
    514.8 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    546°C

    Flash point

    • 227.91 ˚C est.

  • Synonyms

    • 221446-54-4
    • SCHEMBL428727
    • DTXSID30726968
    • NSFSVQXYLWDILV-UHFFFAOYSA-N
    • 2-Hydroxypropanoic acid--N-[3-(dimethylamino)propyl]docosanamide (1/1)
    • 221446-54-4

  • Applications

    N-[3-(dimethylamino)propyl]docosanamide;2-hydroxypropanoic acid, CAS number: 221446-54-4, is a cationic fatty amide salt whose primary applications are as a surfactant and conditioning agent in cosmetics and personal care formulations, notably improving slip and manageability in shampoos and conditioners; it also functions as an emulsifier and wetting agent in household cleaning products and bath formulations; in industrial manufacturing it can act as a surfactant additive to stabilize polymer emulsions and to improve wetting, dispersion, and formulation compatibility in coatings and inks; and it may be evaluated as a surface-active additive for lubricants or as a specialty additive in adhesives to modify surface properties.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 5.25
    methanol 8.66
    isopropanol 4.55
    water 0.3
    ethyl acetate 37.76
    n-propanol 8.03
    acetone 20.04
    n-butanol 9.33
    acetonitrile 6.67
    DMF 44.59
    toluene 16.87
    isobutanol 9.22
    1,4-dioxane 39.96
    methyl acetate 26.62
    THF 103.9
    2-butanone 35.36
    n-pentanol 9.93
    sec-butanol 10.43
    n-hexane 6.09
    ethylene glycol 1.34
    NMP 232.29
    cyclohexane 24.09
    DMSO 57.52
    n-butyl acetate 50.56
    n-octanol 19.86
    chloroform 187.87
    n-propyl acetate 54.44
    acetic acid 33.76
    dichloromethane 149.03
    cyclohexanone 136.69
    propylene glycol 3.48
    isopropyl acetate 41.56
    DMAc 151.11
    2-ethoxyethanol 26.79
    isopentanol 13.64
    n-heptane 7.27
    ethyl formate 22.52
    1,2-dichloroethane 78.1
    n-hexanol 10.45
    2-methoxyethanol 22.51
    isobutyl acetate 41.35
    tetrachloromethane 61.49
    n-pentyl acetate 93.45
    transcutol 172.41
    n-heptanol 18.71
    ethylbenzene 14.88
    MIBK 35.61
    2-propoxyethanol 29.13
    tert-butanol 11.36
    MTBE 25.68
    2-butoxyethanol 53.7
    propionic acid 26.95
    o-xylene 23.3
    formic acid 12.11
    diethyl ether 16.5
    m-xylene 16.22
    p-xylene 22.96
    chlorobenzene 36.67
    dimethyl carbonate 17.33
    n-octane 4.04
    formamide 16.53
    cyclopentanone 131.16
    2-pentanone 33.79
    anisole 26.89
    cyclopentyl methyl ether 72.66
    gamma-butyrolactone 141.19
    1-methoxy-2-propanol 24.42
    pyridine 47.02
    3-pentanone 41.38
    furfural 111.73
    n-dodecane 2.01
    diethylene glycol 13.25
    diisopropyl ether 13.74
    tert-amyl alcohol 22.32
    acetylacetone 52.43
    n-hexadecane 2.38
    acetophenone 53.26
    methyl propionate 36.58
    isopentyl acetate 57.46
    trichloroethylene 173.19
    n-nonanol 21.7
    cyclohexanol 33.4
    benzyl alcohol 19.75
    2-ethylhexanol 17.84
    isooctanol 21.89
    dipropyl ether 32.35
    1,2-dichlorobenzene 57.09
    ethyl lactate 32.37
    propylene carbonate 105.99
    n-methylformamide 19.68
    2-pentanol 9.73
    n-pentane 3.93
    1-propoxy-2-propanol 37.51
    1-methoxy-2-propyl acetate 62.8
    2-(2-methoxypropoxy) propanol 59.1
    mesitylene 15.16
    ε-caprolactone 149.05
    p-cymene 18.14
    epichlorohydrin 112.61
    1,1,1-trichloroethane 117.89
    2-aminoethanol 4.74
    morpholine-4-carbaldehyde 106.97
    sulfolane 293.41
    2,2,4-trimethylpentane 7.57
    2-methyltetrahydrofuran 82.75
    n-hexyl acetate 79.81
    isooctane 3.02
    2-(2-butoxyethoxy)ethanol 67.28
    sec-butyl acetate 51.06
    tert-butyl acetate 66.02
    decalin 10.12
    glycerin 8.85
    diglyme 161.66
    acrylic acid 23.58
    isopropyl myristate 25.83
    n-butyric acid 48.66
    acetyl acetate 36.47
    di(2-ethylhexyl) phthalate 30.54
    ethyl propionate 49.64
    nitromethane 51.07
    1,2-diethoxyethane 61.42
    benzonitrile 23.98
    trioctyl phosphate 20.81
    1-bromopropane 41.4
    gamma-valerolactone 172.15
    n-decanol 12.77
    triethyl phosphate 56.18
    4-methyl-2-pentanol 10.53
    propionitrile 9.87
    vinylene carbonate 81.94
    1,1,2-trichlorotrifluoroethane 139.6
    DMS 45.32
    cumene 14.39
    2-octanol 17.45
    2-hexanone 42.55
    octyl acetate 32.91
    limonene 30.38
    1,2-dimethoxyethane 63.26
    ethyl orthosilicate 57.55
    tributyl phosphate 30.76
    diacetone alcohol 56.21
    N,N-dimethylaniline 27.72
    acrylonitrile 11.16
    aniline 19.6
    1,3-propanediol 8.09
    bromobenzene 42.54
    dibromomethane 90.26
    1,1,2,2-tetrachloroethane 192.79
    2-methyl-cyclohexyl acetate 70.98
    tetrabutyl urea 44.35
    diisobutyl methanol 15.16
    2-phenylethanol 20.16
    styrene 15.34
    dioctyl adipate 52.97
    dimethyl sulfate 62.34
    ethyl butyrate 66.09
    methyl lactate 23.61
    butyl lactate 69.9
    diethyl carbonate 41.94
    propanediol butyl ether 40.68
    triethyl orthoformate 73.72
    p-tert-butyltoluene 16.68
    methyl 4-tert-butylbenzoate 84.88
    morpholine 56.04
    tert-butylamine 9.59
    n-dodecanol 8.5
    dimethoxymethane 25.93
    ethylene carbonate 70.94
    cyrene 75.93
    2-ethoxyethyl acetate 98.67
    2-ethylhexyl acetate 58.39
    1,2,4-trichlorobenzene 77.7
    4-methylpyridine 43.12
    dibutyl ether 39.75
    2,6-dimethyl-4-heptanol 15.16
    DEF 67.6
    dimethyl isosorbide 133.43
    tetrachloroethylene 142.01
    eugenol 62.71
    triacetin 116.3
    span 80 53.46
    1,4-butanediol 4.74
    1,1-dichloroethane 61.52
    2-methyl-1-pentanol 16.34
    methyl formate 16.58
    2-methyl-1-butanol 15.72
    n-decane 5.13
    butyronitrile 11.75
    3,7-dimethyl-1-octanol 21.81
    1-chlorooctane 22.64
    1-chlorotetradecane 6.33
    n-nonane 4.93
    undecane 2.94
    tert-butylcyclohexane 7.61
    cyclooctane 8.12
    cyclopentanol 31.01
    tetrahydropyran 59.46
    tert-amyl methyl ether 39.6
    2,5,8-trioxanonane 92.59
    1-hexene 11.72
    2-isopropoxyethanol 25.97
    2,2,2-trifluoroethanol 28.93
    methyl butyrate 68.02

    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