Amyl isoeugenol

  • Identifiers

    Molecular formula
    C15H22O2

    SMILES
    CCCCCOC1=C(C=C(C=C1)/C=C/C)OC

  • Odor profile

    Fragrance
    Floral 79.95%
    Spicy 78.82%
    Sweet 68.81%
    Balsamic 58.42%
    Clove 46.22%
    Warm 39.08%
    Vanilla 38.45%
    Powdery 35.07%
    Herbal 34.92%
    Woody 32.82%

     

    Flavor
    Spicy 51.54%
    Balsam 41.11%
    Floral 39.16%
    Sweet 36.96%
    Spice 36.45%
    Bitter 34.3%
    Green 33.97%
    Clove 31.19%
    Fresh 31.05%
    Herbal 30.63%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    4.6

    pKa est.
    7.82 (neutral)

    Molecular weight
    234.33 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    315°C

    Flash point

    • 127.0 ˚C est.

  • Synonyms

    • Amyl isoeugenol
    • Amyloxyisoeugenol
    • Amyl isoeugenol ether
    • Isoeugenol amyl ether
    • EINECS 233-996-2
    • 1-Pentoxy-2-methoxy-4-propenylbenzene
    • BRN 3205600
    • AI3-20971
    • Benzene, 2-methoxy-1-(pentyloxy)-4-propenyl-
    • 2-Methoxy-1-(pentyloxy)-4-(1-propenyl)-benzene
    • 3-06-00-05001 (Beilstein Handbook Reference)
    • 2-Pentyloxy-5-prop-1-enylanisole
    • SCHEMBL3506170
    • Benzene, 2-methoxy-1-(pentyloxy)-4-(1-propen-1-yl)-
  • Applications

    Amyl isoeugenol is primarily used as a fragrance ingredient and fixative in the fragrance and cosmetic sectors, and as a scented component in household products such as surface cleaners, air fresheners, and detergents to impart and extend aroma. It is also considered a precursor or intermediate in the synthesis of aroma chemicals and related vanillin derivatives in industrial chemical production. In coatings, inks, and adhesives, amyl isoeugenol may be added to impart a characteristic scent to the final product. Because of its aroma properties, use is typically governed by local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 5068.59
    methanol 3900.63
    isopropanol 3426.89
    water 0.35
    ethyl acetate 12137.63
    n-propanol 4269.86
    acetone 11291.09
    n-butanol 4583.41
    acetonitrile 8408.44
    DMF 6153.63
    toluene 3654.13
    isobutanol 3270.73
    1,4-dioxane 8107.44
    methyl acetate 7549.49
    THF 6726.52
    2-butanone 6998.84
    n-pentanol 2285.8
    sec-butanol 3303.49
    n-hexane 1042.96
    ethylene glycol 598.61
    NMP 4006.76
    cyclohexane 3036.62
    DMSO 8037.96
    n-butyl acetate 5546.0
    n-octanol 872.83
    chloroform 17221.9
    n-propyl acetate 4520.69
    acetic acid 4862.1
    dichloromethane 21785.21
    cyclohexanone 9069.32
    propylene glycol 868.95
    isopropyl acetate 5204.14
    DMAc 3564.4
    2-ethoxyethanol 3143.58
    isopentanol 3459.49
    n-heptane 484.49
    ethyl formate 4099.62
    1,2-dichloroethane 18504.23
    n-hexanol 2783.41
    2-methoxyethanol 5724.91
    isobutyl acetate 2165.31
    tetrachloromethane 3023.71
    n-pentyl acetate 2256.09
    transcutol 7858.46
    n-heptanol 849.85
    ethylbenzene 1459.54
    MIBK 2803.59
    2-propoxyethanol 3445.35
    tert-butanol 4497.09
    MTBE 6424.18
    2-butoxyethanol 1540.88
    propionic acid 3435.26
    o-xylene 1557.66
    formic acid 841.12
    diethyl ether 11406.84
    m-xylene 1863.97
    p-xylene 1593.07
    chlorobenzene 5477.4
    dimethyl carbonate 2455.3
    n-octane 200.31
    formamide 1926.18
    cyclopentanone 7208.02
    2-pentanone 7021.04
    anisole 2607.68
    cyclopentyl methyl ether 5337.81
    gamma-butyrolactone 6722.63
    1-methoxy-2-propanol 3756.69
    pyridine 7550.77
    3-pentanone 5457.2
    furfural 4902.02
    n-dodecane 117.78
    diethylene glycol 1956.73
    diisopropyl ether 2313.46
    tert-amyl alcohol 3514.59
    acetylacetone 6355.32
    n-hexadecane 144.39
    acetophenone 2085.19
    methyl propionate 6857.67
    isopentyl acetate 3589.21
    trichloroethylene 24083.16
    n-nonanol 755.99
    cyclohexanol 4878.62
    benzyl alcohol 1925.94
    2-ethylhexanol 1618.61
    isooctanol 742.62
    dipropyl ether 2911.69
    1,2-dichlorobenzene 4231.3
    ethyl lactate 1091.18
    propylene carbonate 4023.23
    n-methylformamide 3246.05
    2-pentanol 3436.15
    n-pentane 1110.41
    1-propoxy-2-propanol 2446.9
    1-methoxy-2-propyl acetate 3184.13
    2-(2-methoxypropoxy) propanol 1088.63
    mesitylene 1086.6
    ε-caprolactone 6516.5
    p-cymene 693.32
    epichlorohydrin 11287.26
    1,1,1-trichloroethane 13142.01
    2-aminoethanol 1408.95
    morpholine-4-carbaldehyde 3923.68
    sulfolane 6534.25
    2,2,4-trimethylpentane 398.32
    2-methyltetrahydrofuran 6834.61
    n-hexyl acetate 2624.61
    isooctane 318.4
    2-(2-butoxyethoxy)ethanol 1830.25
    sec-butyl acetate 2559.58
    tert-butyl acetate 4126.45
    decalin 670.6
    glycerin 1005.14
    diglyme 3974.18
    acrylic acid 2567.25
    isopropyl myristate 872.75
    n-butyric acid 6643.91
    acetyl acetate 5826.54
    di(2-ethylhexyl) phthalate 558.63
    ethyl propionate 3899.92
    nitromethane 9521.1
    1,2-diethoxyethane 5023.29
    benzonitrile 2813.25
    trioctyl phosphate 486.07
    1-bromopropane 10023.38
    gamma-valerolactone 6999.1
    n-decanol 523.9
    triethyl phosphate 848.16
    4-methyl-2-pentanol 1362.5
    propionitrile 5075.1
    vinylene carbonate 3565.7
    1,1,2-trichlorotrifluoroethane 5499.63
    DMS 2321.36
    cumene 763.11
    2-octanol 660.66
    2-hexanone 3371.21
    octyl acetate 1081.17
    limonene 1270.1
    1,2-dimethoxyethane 5378.12
    ethyl orthosilicate 884.32
    tributyl phosphate 752.68
    diacetone alcohol 2852.0
    N,N-dimethylaniline 1263.88
    acrylonitrile 5347.68
    aniline 3786.6
    1,3-propanediol 2559.23
    bromobenzene 6751.98
    dibromomethane 14531.76
    1,1,2,2-tetrachloroethane 18535.17
    2-methyl-cyclohexyl acetate 1419.79
    tetrabutyl urea 862.63
    diisobutyl methanol 797.91
    2-phenylethanol 1835.08
    styrene 2318.5
    dioctyl adipate 1092.07
    dimethyl sulfate 2474.66
    ethyl butyrate 3050.53
    methyl lactate 1467.91
    butyl lactate 1199.35
    diethyl carbonate 1744.88
    propanediol butyl ether 1157.06
    triethyl orthoformate 1511.07
    p-tert-butyltoluene 614.41
    methyl 4-tert-butylbenzoate 1139.27
    morpholine 9675.2
    tert-butylamine 3086.8
    n-dodecanol 407.39
    dimethoxymethane 5578.65
    ethylene carbonate 3631.28
    cyrene 978.72
    2-ethoxyethyl acetate 2991.06
    2-ethylhexyl acetate 2814.66
    1,2,4-trichlorobenzene 4254.3
    4-methylpyridine 6594.4
    dibutyl ether 2157.97
    2,6-dimethyl-4-heptanol 797.91
    DEF 6639.56
    dimethyl isosorbide 1814.43
    tetrachloroethylene 11061.63
    eugenol 1032.57
    triacetin 1768.31
    span 80 1079.75
    1,4-butanediol 890.34
    1,1-dichloroethane 15677.21
    2-methyl-1-pentanol 2177.49
    methyl formate 2869.99
    2-methyl-1-butanol 3661.22
    n-decane 221.84
    butyronitrile 5899.81
    3,7-dimethyl-1-octanol 953.11
    1-chlorooctane 1104.0
    1-chlorotetradecane 357.6
    n-nonane 244.06
    undecane 154.16
    tert-butylcyclohexane 488.06
    cyclooctane 767.74
    cyclopentanol 2968.64
    tetrahydropyran 10974.74
    tert-amyl methyl ether 3560.43
    2,5,8-trioxanonane 2057.91
    1-hexene 2806.03
    2-isopropoxyethanol 2204.91
    2,2,2-trifluoroethanol 1330.23
    methyl butyrate 4834.23

    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