J5657VM5YQ

Overview IFRA Request a quote

  • Identifiers

    CAS number
    1857331-83-9

    Molecular formula
    C20H28N2O

    SMILES
    CC(C)[C@H]1CCC(C[C@@H]1C(=O)NC2=CC=C(C=C2)CC#N)(C)C

    Safety labels

  • Odor profile

    Fragrance
    Cooling 37.44%
    Mint 36.77%
    Grapefruit 33.22%
    Animal 32.24%
    Citrus 30.63%
    Woody 29.11%
    Odorless 26.46%
    Spicy 24.49%
    Fresh 24.11%
    Herbal 23.85%

     

    Flavor
    Bitter 34.92%
    Herbal 28.74%
    Mild 25.62%
    Odorless 23.45%
    Cedarleaf 19.88%
    Woody 19.5%
    Nitrile 19.14%
    Creosote 18.82%
    Green pepper 18.77%
    Heather 18.68%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    4.7

    pKa est.
    7.2 (neutral)

    Molecular weight
    312.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    526°C

    Flash point

    • 195.58 ˚C est.

  • Synonyms

    • Fema No. 4882
    • J5657VM5YQ
    • UNII-J5657VM5YQ
    • N-(4-(Cyanomethyl)phenyl)-2-isopropyl-5,5-dimethylcyclohexanecarboxamide
    • Cyclohexanecarboxamide, N-(4-(cyanomethyl)phenyl)-5,5-dimethyl-2-(1-methylethyl)-, (1R,2S)-
    • 1857331-83-9
    • SCHEMBL18105714
    • 1857331-83-9

  • Applications

    J5657VM5YQ, CAS 1857331-83-9, can serve as an industrial intermediate and as a solvent or co-solvent in manufacturing processes. It is commonly used as a processing aid in polymer formulations and in coatings, inks, and adhesives to improve solubility, processability, and formulation stability. The compound may also function as a stabilizer or plasticizer in polymers to enhance processing performance and the mechanical properties of the material. Use and formulation are subject to local regulations and limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 79.69
    methanol 111.88
    isopropanol 44.96
    water 0.36
    ethyl acetate 93.28
    n-propanol 67.45
    acetone 160.79
    n-butanol 48.44
    acetonitrile 62.17
    DMF 319.49
    toluene 47.26
    isobutanol 40.59
    1,4-dioxane 134.28
    methyl acetate 97.95
    THF 265.63
    2-butanone 132.66
    n-pentanol 44.12
    sec-butanol 31.67
    n-hexane 1.43
    ethylene glycol 20.29
    NMP 164.31
    cyclohexane 2.99
    DMSO 219.42
    n-butyl acetate 83.47
    n-octanol 29.46
    chloroform 267.74
    n-propyl acetate 67.83
    acetic acid 89.88
    dichloromethane 184.07
    cyclohexanone 162.35
    propylene glycol 32.82
    isopropyl acetate 65.01
    DMAc 314.47
    2-ethoxyethanol 85.98
    isopentanol 40.62
    n-heptane 1.64
    ethyl formate 71.82
    1,2-dichloroethane 130.82
    n-hexanol 54.58
    2-methoxyethanol 114.18
    isobutyl acetate 60.66
    tetrachloromethane 16.42
    n-pentyl acetate 53.22
    transcutol 210.55
    n-heptanol 33.66
    ethylbenzene 25.08
    MIBK 66.9
    2-propoxyethanol 122.38
    tert-butanol 38.04
    MTBE 30.93
    2-butoxyethanol 82.43
    propionic acid 65.22
    o-xylene 23.51
    formic acid 48.57
    diethyl ether 38.21
    m-xylene 30.61
    p-xylene 35.63
    chlorobenzene 85.42
    dimethyl carbonate 60.42
    n-octane 1.19
    formamide 63.11
    cyclopentanone 216.16
    2-pentanone 93.68
    anisole 66.2
    cyclopentyl methyl ether 61.92
    gamma-butyrolactone 200.17
    1-methoxy-2-propanol 92.56
    pyridine 138.67
    3-pentanone 78.84
    furfural 165.85
    n-dodecane 1.35
    diethylene glycol 88.66
    diisopropyl ether 11.0
    tert-amyl alcohol 26.5
    acetylacetone 136.61
    n-hexadecane 1.61
    acetophenone 78.03
    methyl propionate 86.66
    isopentyl acetate 81.14
    trichloroethylene 251.38
    n-nonanol 28.39
    cyclohexanol 33.48
    benzyl alcohol 63.16
    2-ethylhexanol 30.48
    isooctanol 27.27
    dipropyl ether 29.13
    1,2-dichlorobenzene 73.58
    ethyl lactate 50.12
    propylene carbonate 110.31
    n-methylformamide 108.03
    2-pentanol 22.75
    n-pentane 1.04
    1-propoxy-2-propanol 81.46
    1-methoxy-2-propyl acetate 99.23
    2-(2-methoxypropoxy) propanol 69.73
    mesitylene 16.23
    ε-caprolactone 115.04
    p-cymene 18.08
    epichlorohydrin 215.53
    1,1,1-trichloroethane 93.24
    2-aminoethanol 43.93
    morpholine-4-carbaldehyde 156.44
    sulfolane 192.06
    2,2,4-trimethylpentane 1.16
    2-methyltetrahydrofuran 100.03
    n-hexyl acetate 66.69
    isooctane 1.11
    2-(2-butoxyethoxy)ethanol 91.54
    sec-butyl acetate 48.82
    tert-butyl acetate 63.18
    decalin 2.5
    glycerin 47.35
    diglyme 163.81
    acrylic acid 64.35
    isopropyl myristate 27.47
    n-butyric acid 85.17
    acetyl acetate 77.75
    di(2-ethylhexyl) phthalate 38.4
    ethyl propionate 57.22
    nitromethane 168.6
    1,2-diethoxyethane 71.96
    benzonitrile 75.79
    trioctyl phosphate 27.24
    1-bromopropane 52.66
    gamma-valerolactone 239.4
    n-decanol 21.07
    triethyl phosphate 31.82
    4-methyl-2-pentanol 20.08
    propionitrile 63.82
    vinylene carbonate 111.06
    1,1,2-trichlorotrifluoroethane 157.03
    DMS 75.16
    cumene 18.38
    2-octanol 19.61
    2-hexanone 75.8
    octyl acetate 37.57
    limonene 19.69
    1,2-dimethoxyethane 125.49
    ethyl orthosilicate 29.54
    tributyl phosphate 30.0
    diacetone alcohol 74.48
    N,N-dimethylaniline 42.38
    acrylonitrile 83.08
    aniline 57.59
    1,3-propanediol 59.37
    bromobenzene 80.77
    dibromomethane 110.29
    1,1,2,2-tetrachloroethane 209.87
    2-methyl-cyclohexyl acetate 54.03
    tetrabutyl urea 40.91
    diisobutyl methanol 16.77
    2-phenylethanol 71.87
    styrene 31.45
    dioctyl adipate 47.3
    dimethyl sulfate 89.98
    ethyl butyrate 55.32
    methyl lactate 63.14
    butyl lactate 55.13
    diethyl carbonate 41.44
    propanediol butyl ether 64.87
    triethyl orthoformate 41.48
    p-tert-butyltoluene 15.83
    methyl 4-tert-butylbenzoate 69.43
    morpholine 149.78
    tert-butylamine 16.68
    n-dodecanol 15.61
    dimethoxymethane 139.01
    ethylene carbonate 91.56
    cyrene 80.78
    2-ethoxyethyl acetate 85.39
    2-ethylhexyl acetate 60.46
    1,2,4-trichlorobenzene 88.33
    4-methylpyridine 119.51
    dibutyl ether 23.64
    2,6-dimethyl-4-heptanol 16.77
    DEF 82.2
    dimethyl isosorbide 121.27
    tetrachloroethylene 109.81
    eugenol 77.07
    triacetin 79.2
    span 80 60.25
    1,4-butanediol 33.02
    1,1-dichloroethane 111.54
    2-methyl-1-pentanol 36.62
    methyl formate 94.36
    2-methyl-1-butanol 33.81
    n-decane 2.37
    butyronitrile 63.17
    3,7-dimethyl-1-octanol 27.91
    1-chlorooctane 16.45
    1-chlorotetradecane 6.31
    n-nonane 1.88
    undecane 1.73
    tert-butylcyclohexane 2.35
    cyclooctane 1.0
    cyclopentanol 45.4
    tetrahydropyran 107.83
    tert-amyl methyl ether 22.14
    2,5,8-trioxanonane 107.61
    1-hexene 11.16
    2-isopropoxyethanol 65.64
    2,2,2-trifluoroethanol 38.86
    methyl butyrate 78.17

    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