4-n-Nonylcyclohexanone

  • Identifiers

    Molecular formula
    C15H28O

    SMILES
    CCCCCCCCCC1CCC(=O)CC1

  • Odor profile

    Fragrance
    Waxy 66.31%
    Fatty 65.67%
    Floral 48.68%
    Fruity 48.14%
    Oily 45.04%
    Creamy 42.59%
    Sweet 40.79%
    Jasmin 40.66%
    Coconut 40.38%
    Dairy 40.14%

     

    Flavor
    Waxy 57.03%
    Fatty 55.67%
    Fruity 46.87%
    Creamy 40.31%
    Coconut 38.63%
    Fresh 36.79%
    Sweet 36.38%
    Fat 33.9%
    Peach 33.65%
    Oily 32.86%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    5.5

    pKa est.
    8.21 (weak base)

    Molecular weight
    224.38 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    313°C

    Flash point

    • 125.25 ˚C est.

  • Synonyms

    • 4-n-nonylcyclohexanone
    • SCHEMBL9139886
    • YTDCDFCXYVCDHJ-UHFFFAOYSA-N
    • AKOS021583656
  • Applications

    4-n-Nonylcyclohexanone is a cyclohexanone derivative with a 4-nonyl substituent. It is considered a fragrance intermediate and may serve as a fragrance component or fixative in the perfumery industry; it can also be used as a fragrance ingredient in cosmetic and personal care formulations. In household products, it may function as a fragrance additive or solvent for cleaners and air fresheners. In industrial manufacturing, it can be used as a solvent or processing aid in coatings, inks, and adhesives. In the polymers and plastics sector, it may act as a processing aid or intermediate in specialty polymer synthesis.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1480.8
    methanol 739.14
    isopropanol 1903.95
    water 0.01
    ethyl acetate 4100.89
    n-propanol 1495.78
    acetone 3777.89
    n-butanol 1657.87
    acetonitrile 1681.73
    DMF 1566.51
    toluene 1307.51
    isobutanol 1153.27
    1,4-dioxane 3669.55
    methyl acetate 2154.31
    THF 5375.05
    2-butanone 3420.29
    n-pentanol 980.87
    sec-butanol 1503.69
    n-hexane 699.51
    ethylene glycol 40.79
    NMP 1247.73
    cyclohexane 1214.03
    DMSO 1830.51
    n-butyl acetate 3409.92
    n-octanol 479.94
    chloroform 5601.79
    n-propyl acetate 2839.69
    acetic acid 602.56
    dichloromethane 5217.24
    cyclohexanone 4595.51
    propylene glycol 147.53
    isopropyl acetate 2850.4
    DMAc 1377.63
    2-ethoxyethanol 1183.05
    isopentanol 1655.38
    n-heptane 392.25
    ethyl formate 1282.18
    1,2-dichloroethane 3820.62
    n-hexanol 1186.91
    2-methoxyethanol 1666.72
    isobutyl acetate 1620.74
    tetrachloromethane 991.87
    n-pentyl acetate 1875.69
    transcutol 6004.21
    n-heptanol 500.16
    ethylbenzene 715.59
    MIBK 1971.25
    2-propoxyethanol 1756.34
    tert-butanol 2279.63
    MTBE 3617.71
    2-butoxyethanol 1050.2
    propionic acid 776.11
    o-xylene 740.88
    formic acid 59.88
    diethyl ether 4484.94
    m-xylene 801.07
    p-xylene 884.01
    chlorobenzene 1706.51
    dimethyl carbonate 357.45
    n-octane 120.61
    formamide 143.03
    cyclopentanone 3354.28
    2-pentanone 3549.97
    anisole 1327.11
    cyclopentyl methyl ether 2865.94
    gamma-butyrolactone 2771.95
    1-methoxy-2-propanol 1760.05
    pyridine 3097.89
    3-pentanone 2092.12
    furfural 2010.44
    n-dodecane 61.46
    diethylene glycol 516.71
    diisopropyl ether 1276.49
    tert-amyl alcohol 1585.17
    acetylacetone 2700.99
    n-hexadecane 77.67
    acetophenone 1111.86
    methyl propionate 1789.72
    isopentyl acetate 2842.9
    trichloroethylene 5092.34
    n-nonanol 453.41
    cyclohexanol 1795.62
    benzyl alcohol 739.59
    2-ethylhexanol 974.32
    isooctanol 513.54
    dipropyl ether 2595.88
    1,2-dichlorobenzene 1527.24
    ethyl lactate 540.5
    propylene carbonate 1696.06
    n-methylformamide 601.42
    2-pentanol 1317.0
    n-pentane 405.43
    1-propoxy-2-propanol 1856.44
    1-methoxy-2-propyl acetate 2265.02
    2-(2-methoxypropoxy) propanol 865.14
    mesitylene 563.66
    ε-caprolactone 3315.04
    p-cymene 465.27
    epichlorohydrin 3900.13
    1,1,1-trichloroethane 3836.07
    2-aminoethanol 215.66
    morpholine-4-carbaldehyde 1833.12
    sulfolane 2504.34
    2,2,4-trimethylpentane 158.03
    2-methyltetrahydrofuran 4390.5
    n-hexyl acetate 1914.97
    isooctane 151.51
    2-(2-butoxyethoxy)ethanol 1344.32
    sec-butyl acetate 1982.15
    tert-butyl acetate 2786.53
    decalin 331.44
    glycerin 182.58
    diglyme 2942.05
    acrylic acid 384.34
    isopropyl myristate 678.4
    n-butyric acid 2322.22
    acetyl acetate 1632.68
    di(2-ethylhexyl) phthalate 387.93
    ethyl propionate 2151.34
    nitromethane 1439.81
    1,2-diethoxyethane 3878.74
    benzonitrile 1318.27
    trioctyl phosphate 300.44
    1-bromopropane 3259.26
    gamma-valerolactone 3879.78
    n-decanol 311.97
    triethyl phosphate 641.84
    4-methyl-2-pentanol 767.68
    propionitrile 1970.35
    vinylene carbonate 1250.51
    1,1,2-trichlorotrifluoroethane 1608.33
    DMS 950.15
    cumene 464.68
    2-octanol 424.43
    2-hexanone 2311.41
    octyl acetate 708.72
    limonene 861.76
    1,2-dimethoxyethane 3336.62
    ethyl orthosilicate 673.34
    tributyl phosphate 457.24
    diacetone alcohol 1689.44
    N,N-dimethylaniline 689.36
    acrylonitrile 1439.94
    aniline 1154.59
    1,3-propanediol 600.78
    bromobenzene 2037.34
    dibromomethane 3944.56
    1,1,2,2-tetrachloroethane 4459.73
    2-methyl-cyclohexyl acetate 1181.01
    tetrabutyl urea 534.61
    diisobutyl methanol 659.19
    2-phenylethanol 790.24
    styrene 983.12
    dioctyl adipate 855.5
    dimethyl sulfate 495.14
    ethyl butyrate 2432.72
    methyl lactate 420.73
    butyl lactate 919.71
    diethyl carbonate 1197.97
    propanediol butyl ether 662.33
    triethyl orthoformate 1454.96
    p-tert-butyltoluene 450.72
    methyl 4-tert-butylbenzoate 839.39
    morpholine 4660.34
    tert-butylamine 1612.66
    n-dodecanol 233.43
    dimethoxymethane 1559.26
    ethylene carbonate 1419.71
    cyrene 548.88
    2-ethoxyethyl acetate 2018.95
    2-ethylhexyl acetate 2069.54
    1,2,4-trichlorobenzene 1598.22
    4-methylpyridine 2928.83
    dibutyl ether 2016.26
    2,6-dimethyl-4-heptanol 659.19
    DEF 2575.69
    dimethyl isosorbide 1464.33
    tetrachloroethylene 2565.54
    eugenol 663.14
    triacetin 1282.87
    span 80 795.43
    1,4-butanediol 181.01
    1,1-dichloroethane 4327.93
    2-methyl-1-pentanol 929.45
    methyl formate 382.71
    2-methyl-1-butanol 1282.08
    n-decane 138.24
    butyronitrile 2540.06
    3,7-dimethyl-1-octanol 685.15
    1-chlorooctane 599.65
    1-chlorotetradecane 195.15
    n-nonane 147.5
    undecane 86.19
    tert-butylcyclohexane 277.15
    cyclooctane 316.72
    cyclopentanol 1397.97
    tetrahydropyran 5993.51
    tert-amyl methyl ether 1940.21
    2,5,8-trioxanonane 1537.05
    1-hexene 1960.81
    2-isopropoxyethanol 1047.87
    2,2,2-trifluoroethanol 155.46
    methyl butyrate 2904.57

    Scent© AI

1 of 4
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