1H-Imidazolium, 4,5-dihydro-1-(2-hydroxyethyl)-2-isoheptadecyl-1-(phenylmethyl)-, chloride (1:1)

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  • Identifiers

    CAS number
    67633-58-3

    Molecular formula
    C29H51ClN2O

    SMILES
    CC(C)CCCCCCCCCCCCCCC1=NCC[N+]1(CCO)CC2=CC=CC=C2.[Cl-]

    Safety labels

  • Odor profile

    Fragrance
    Waxy 54.16%
    Fatty 34.5%
    Floral 33.11%
    Oily 32.87%
    Woody 29.9%
    Animal 29.88%
    Fresh 29.03%
    Odorless 24.37%
    Balsamic 23.9%
    Fishy 23.34%

     

    Flavor
    Mild 27.37%
    Bland 26.99%
    Waxy 24.1%
    Delicate 20.95%
    Slightly waxy 20.72%
    Diterpene 19.85%
    Cedarleaf 19.5%
    Odorless 19.42%
    Low 19.39%
    Bay oil 19.39%

     

    Odor impact est.
    Low

  • Properties

    pKa est.
    8.4 (weak base)

    Molecular weight
    479.2 g/mol

    Flash point

    • 119.34 ˚C est.

  • Synonyms

    • 67633-58-3
    • 2-Isoheptadecyl-1-hydroxyethyl-1-benzylimidazolinium chloride
    • 1H-Imidazolium, 4,5-dihydro-1-(2-hydroxyethyl)-2-isoheptadecyl-1-(phenylmethyl)-, chloride
    • 1H-Imidazolium, 4,5-dihydro-1-(2-hydroxyethyl)-2-isoheptadecyl-1-(phenylmethyl)-, chloride (1:1)
    • RefChem:438525
    • 84625-60-5
    • ISOSTEARYL BENZYLIMIDONIUM CHLORIDE
    • 1-Benzyl-4,5-dihydro-1-(2-hydroxyethyl)-2-(15-methylhexadecyl)-1H-imidazolium chloride
    • C1P094Q60B
    • UNII-C1P094Q60B
    • EINECS 283-429-8
    • 1-benzyl-1-(2-hydroxyethyl)-2-(15-methylhexadecyl)-4,5-dihydro-1h-imidazol-1-ium chloride
    • SCHEMBL4071097
    • DTXSID20987001
    • IZHSCDOXRKNGBC-UHFFFAOYSA-M
    • NS00060240
    • Q27275066
    • 1H-IMIDAZOLIUM, 4,5-DIHYDRO-1-(2-HYDROXYETHYL)-2-(15-METHYLHEXADECYL)-1-(PHENYLMETHYL)-, CHLORIDE (1:1)
    • 84625-60-5

  • Applications

    1H-Imidazolium, 4,5-dihydro-1-(2-hydroxyethyl)-2-isoheptadecyl-1-(phenylmethyl)-, chloride (1:1) (CAS 67633-58-3) has potential applications as an amphiphilic ionic liquid solvent and reaction medium for organic synthesis; it can function as a phase-transfer catalyst or stabilizer in the synthesis of nanoparticles and in polymer processing; it acts as a surfactant and dispersant in coatings, paints, and inks; it serves as a processing solvent and plasticizer/additive in polymer and plastic formulations; it may act as a lubricant additive for specialty lubricants; and it can operate as an electrolyte or electrolyte component in electronics and energy-storage devices.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 240.33
    methanol 205.18
    isopropanol 208.13
    water 1.14
    ethyl acetate 1119.8
    n-propanol 332.47
    acetone 799.69
    n-butanol 368.32
    acetonitrile 240.66
    DMF 671.5
    toluene 531.69
    isobutanol 306.71
    1,4-dioxane 997.82
    methyl acetate 673.93
    THF 1858.67
    2-butanone 870.92
    n-pentanol 220.63
    sec-butanol 265.62
    n-hexane 48.04
    ethylene glycol 18.95
    NMP 1003.48
    cyclohexane 245.84
    DMSO 663.77
    n-butyl acetate 734.93
    n-octanol 167.14
    chloroform 3448.4
    n-propyl acetate 772.54
    acetic acid 490.89
    dichloromethane 3468.48
    cyclohexanone 1849.08
    propylene glycol 44.14
    isopropyl acetate 838.0
    DMAc 1110.78
    2-ethoxyethanol 401.46
    isopentanol 367.33
    n-heptane 59.0
    ethyl formate 573.74
    1,2-dichloroethane 1938.95
    n-hexanol 185.92
    2-methoxyethanol 479.83
    isobutyl acetate 564.26
    tetrachloromethane 732.83
    n-pentyl acetate 909.07
    transcutol 1327.83
    n-heptanol 209.99
    ethylbenzene 199.71
    MIBK 640.41
    2-propoxyethanol 412.83
    tert-butanol 264.54
    MTBE 500.56
    2-butoxyethanol 529.11
    propionic acid 392.99
    o-xylene 298.94
    formic acid 116.9
    diethyl ether 597.17
    m-xylene 284.02
    p-xylene 283.3
    chlorobenzene 823.59
    dimethyl carbonate 378.09
    n-octane 24.9
    formamide 199.99
    cyclopentanone 1635.03
    2-pentanone 948.09
    anisole 401.28
    cyclopentyl methyl ether 975.57
    gamma-butyrolactone 1734.8
    1-methoxy-2-propanol 438.39
    pyridine 1085.98
    3-pentanone 793.49
    furfural 1070.21
    n-dodecane 13.38
    diethylene glycol 167.18
    diisopropyl ether 195.05
    tert-amyl alcohol 305.67
    acetylacetone 1100.37
    n-hexadecane 16.5
    acetophenone 493.18
    methyl propionate 760.63
    isopentyl acetate 711.24
    trichloroethylene 3165.97
    n-nonanol 175.62
    cyclohexanol 558.74
    benzyl alcohol 287.22
    2-ethylhexanol 195.15
    isooctanol 218.12
    dipropyl ether 406.03
    1,2-dichlorobenzene 741.17
    ethyl lactate 268.54
    propylene carbonate 1096.04
    n-methylformamide 350.24
    2-pentanol 252.0
    n-pentane 55.83
    1-propoxy-2-propanol 401.85
    1-methoxy-2-propyl acetate 701.37
    2-(2-methoxypropoxy) propanol 317.12
    mesitylene 181.37
    ε-caprolactone 1615.41
    p-cymene 146.13
    epichlorohydrin 2007.01
    1,1,1-trichloroethane 2013.84
    2-aminoethanol 74.85
    morpholine-4-carbaldehyde 883.85
    sulfolane 1721.82
    2,2,4-trimethylpentane 45.9
    2-methyltetrahydrofuran 1314.59
    n-hexyl acetate 677.18
    isooctane 22.63
    2-(2-butoxyethoxy)ethanol 468.46
    sec-butyl acetate 573.38
    tert-butyl acetate 809.21
    decalin 61.15
    glycerin 79.35
    diglyme 1300.96
    acrylic acid 303.69
    isopropyl myristate 205.68
    n-butyric acid 976.68
    acetyl acetate 735.14
    di(2-ethylhexyl) phthalate 191.89
    ethyl propionate 644.26
    nitromethane 939.73
    1,2-diethoxyethane 679.7
    benzonitrile 404.91
    trioctyl phosphate 142.34
    1-bromopropane 1043.85
    gamma-valerolactone 2024.42
    n-decanol 108.74
    triethyl phosphate 295.74
    4-methyl-2-pentanol 177.2
    propionitrile 334.59
    vinylene carbonate 946.98
    1,1,2-trichlorotrifluoroethane 1324.0
    DMS 447.33
    cumene 135.15
    2-octanol 159.52
    2-hexanone 585.83
    octyl acetate 271.82
    limonene 252.34
    1,2-dimethoxyethane 876.78
    ethyl orthosilicate 308.26
    tributyl phosphate 191.53
    diacetone alcohol 591.53
    N,N-dimethylaniline 249.65
    acrylonitrile 312.6
    aniline 470.15
    1,3-propanediol 197.18
    bromobenzene 960.05
    dibromomethane 2073.61
    1,1,2,2-tetrachloroethane 2667.96
    2-methyl-cyclohexyl acetate 449.35
    tetrabutyl urea 239.05
    diisobutyl methanol 134.65
    2-phenylethanol 247.59
    styrene 252.98
    dioctyl adipate 311.03
    dimethyl sulfate 628.43
    ethyl butyrate 661.45
    methyl lactate 278.37
    butyl lactate 504.5
    diethyl carbonate 389.2
    propanediol butyl ether 280.91
    triethyl orthoformate 508.49
    p-tert-butyltoluene 132.3
    methyl 4-tert-butylbenzoate 501.82
    morpholine 1124.91
    tert-butylamine 169.08
    n-dodecanol 73.56
    dimethoxymethane 729.24
    ethylene carbonate 993.86
    cyrene 345.19
    2-ethoxyethyl acetate 1016.55
    2-ethylhexyl acetate 582.06
    1,2,4-trichlorobenzene 910.53
    4-methylpyridine 914.6
    dibutyl ether 365.71
    2,6-dimethyl-4-heptanol 134.65
    DEF 982.18
    dimethyl isosorbide 639.16
    tetrachloroethylene 1753.82
    eugenol 386.64
    triacetin 731.6
    span 80 288.32
    1,4-butanediol 76.65
    1,1-dichloroethane 1664.11
    2-methyl-1-pentanol 254.52
    methyl formate 346.47
    2-methyl-1-butanol 368.17
    n-decane 33.65
    butyronitrile 439.7
    3,7-dimethyl-1-octanol 174.18
    1-chlorooctane 190.08
    1-chlorotetradecane 52.34
    n-nonane 31.07
    undecane 19.36
    tert-butylcyclohexane 43.72
    cyclooctane 59.55
    cyclopentanol 464.63
    tetrahydropyran 1477.04
    tert-amyl methyl ether 433.83
    2,5,8-trioxanonane 606.15
    1-hexene 166.35
    2-isopropoxyethanol 347.24
    2,2,2-trifluoroethanol 327.25
    methyl butyrate 902.78

    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