3,7-Dimethylocta-1,6-dien-3-yl nonanoate

  • Identifiers

    Molecular formula
    C19H34O2

    SMILES
    CCCCCCCCC(=O)OC(C)(CCC=C(C)C)C=C

  • Odor profile

    Fragrance
    Floral 71.91%
    Fruity 66.84%
    Rose 60.76%
    Sweet 54.34%
    Waxy 52.15%
    Green 52.03%
    Citrus 43.24%
    Herbal 42.45%
    Woody 41.24%
    Oily 34.98%

     

    Flavor
    Fruity 65.71%
    Green 48.67%
    Sweet 48.29%
    Herbal 44.19%
    Floral 41.28%
    Woody 39.73%
    Waxy 37.7%
    Bergamot 36.76%
    Rose 36.69%
    Tropical 34.65%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    6.8

    pKa est.
    7.72 (neutral)

    Molecular weight
    294.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    325°C

    Flash point

    • 146.96 ˚C est.

  • Applications

    3,7-Dimethylocta-1,6-dien-3-yl nonanoate is typically used in fragrance applications and cosmetics/personal care as a fragrance ingredient and may function as a fixative to extend scent longevity; it is also employed in household products such as air fresheners and cleaning formulations, and in coatings, inks, and plastics as a fragrance additive for finishes and resin systems. Additionally, it can serve as an intermediate in the synthesis of aroma chemicals.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 4525.46
    methanol 2917.7
    isopropanol 4032.8
    water 0.06
    ethyl acetate 7003.67
    n-propanol 4192.69
    acetone 4378.53
    n-butanol 4293.43
    acetonitrile 1863.83
    DMF 3378.15
    toluene 3071.25
    isobutanol 3762.02
    1,4-dioxane 5546.92
    methyl acetate 3167.69
    THF 8546.46
    2-butanone 5065.21
    n-pentanol 3228.67
    sec-butanol 5059.54
    n-hexane 1827.55
    ethylene glycol 77.88
    NMP 3595.2
    cyclohexane 2809.18
    DMSO 2258.37
    n-butyl acetate 4948.41
    n-octanol 1596.4
    chloroform 7025.68
    n-propyl acetate 3697.81
    acetic acid 1443.44
    dichloromethane 6625.33
    cyclohexanone 7694.89
    propylene glycol 333.29
    isopropyl acetate 5327.97
    DMAc 4314.68
    2-ethoxyethanol 2307.31
    isopentanol 4366.91
    n-heptane 772.51
    ethyl formate 1807.38
    1,2-dichloroethane 4822.99
    n-hexanol 3520.4
    2-methoxyethanol 2776.86
    isobutyl acetate 2658.71
    tetrachloromethane 1250.72
    n-pentyl acetate 3618.48
    transcutol 8427.24
    n-heptanol 1487.98
    ethylbenzene 1826.13
    MIBK 3622.32
    2-propoxyethanol 3414.78
    tert-butanol 4991.43
    MTBE 9449.19
    2-butoxyethanol 1958.2
    propionic acid 1536.56
    o-xylene 1816.8
    formic acid 204.91
    diethyl ether 8902.01
    m-xylene 1937.1
    p-xylene 2285.3
    chlorobenzene 2698.65
    dimethyl carbonate 688.83
    n-octane 298.68
    formamide 367.67
    cyclopentanone 4787.98
    2-pentanone 5486.19
    anisole 2392.16
    cyclopentyl methyl ether 5993.13
    gamma-butyrolactone 3876.22
    1-methoxy-2-propanol 2887.37
    pyridine 4354.16
    3-pentanone 3608.89
    furfural 2366.3
    n-dodecane 165.44
    diethylene glycol 1031.69
    diisopropyl ether 3103.44
    tert-amyl alcohol 5628.75
    acetylacetone 3696.03
    n-hexadecane 202.44
    acetophenone 1967.14
    methyl propionate 3392.29
    isopentyl acetate 5000.06
    trichloroethylene 6589.9
    n-nonanol 1395.68
    cyclohexanol 4811.14
    benzyl alcohol 1424.59
    2-ethylhexanol 2436.0
    isooctanol 1396.57
    dipropyl ether 3523.19
    1,2-dichlorobenzene 2319.44
    ethyl lactate 831.47
    propylene carbonate 2548.11
    n-methylformamide 1215.6
    2-pentanol 4114.88
    n-pentane 1236.62
    1-propoxy-2-propanol 3036.99
    1-methoxy-2-propyl acetate 3370.35
    2-(2-methoxypropoxy) propanol 1791.34
    mesitylene 1271.04
    ε-caprolactone 6140.14
    p-cymene 991.78
    epichlorohydrin 5447.27
    1,1,1-trichloroethane 5078.27
    2-aminoethanol 509.04
    morpholine-4-carbaldehyde 3463.87
    sulfolane 3552.83
    2,2,4-trimethylpentane 679.77
    2-methyltetrahydrofuran 9494.71
    n-hexyl acetate 4681.97
    isooctane 452.96
    2-(2-butoxyethoxy)ethanol 2549.9
    sec-butyl acetate 3444.42
    tert-butyl acetate 4787.81
    decalin 998.01
    glycerin 317.34
    diglyme 4372.8
    acrylic acid 669.86
    isopropyl myristate 1394.35
    n-butyric acid 4196.93
    acetyl acetate 2504.3
    di(2-ethylhexyl) phthalate 949.15
    ethyl propionate 3454.25
    nitromethane 2144.34
    1,2-diethoxyethane 5203.35
    benzonitrile 1920.93
    trioctyl phosphate 726.8
    1-bromopropane 4982.34
    gamma-valerolactone 5752.84
    n-decanol 892.92
    triethyl phosphate 959.6
    4-methyl-2-pentanol 2320.27
    propionitrile 2364.46
    vinylene carbonate 1813.36
    1,1,2-trichlorotrifluoroethane 2201.67
    DMS 1793.67
    cumene 1160.79
    2-octanol 1434.97
    2-hexanone 3716.41
    octyl acetate 1695.73
    limonene 2179.04
    1,2-dimethoxyethane 4599.76
    ethyl orthosilicate 1115.0
    tributyl phosphate 989.45
    diacetone alcohol 2966.16
    N,N-dimethylaniline 1648.11
    acrylonitrile 1601.76
    aniline 2178.66
    1,3-propanediol 1253.08
    bromobenzene 3187.49
    dibromomethane 5109.03
    1,1,2,2-tetrachloroethane 6271.57
    2-methyl-cyclohexyl acetate 2282.27
    tetrabutyl urea 1299.16
    diisobutyl methanol 1290.71
    2-phenylethanol 1709.46
    styrene 2033.86
    dioctyl adipate 1634.88
    dimethyl sulfate 808.36
    ethyl butyrate 3321.04
    methyl lactate 726.02
    butyl lactate 1732.36
    diethyl carbonate 1547.32
    propanediol butyl ether 1417.72
    triethyl orthoformate 1962.62
    p-tert-butyltoluene 876.18
    methyl 4-tert-butylbenzoate 1737.07
    morpholine 7913.12
    tert-butylamine 3796.91
    n-dodecanol 630.44
    dimethoxymethane 3016.65
    ethylene carbonate 2067.59
    cyrene 1158.47
    2-ethoxyethyl acetate 3365.32
    2-ethylhexyl acetate 3999.18
    1,2,4-trichlorobenzene 2600.12
    4-methylpyridine 5463.62
    dibutyl ether 3846.62
    2,6-dimethyl-4-heptanol 1290.71
    DEF 5267.73
    dimethyl isosorbide 2802.37
    tetrachloroethylene 3808.16
    eugenol 1402.79
    triacetin 2310.0
    span 80 1765.91
    1,4-butanediol 458.59
    1,1-dichloroethane 5487.2
    2-methyl-1-pentanol 3411.54
    methyl formate 723.07
    2-methyl-1-butanol 4152.18
    n-decane 365.27
    butyronitrile 3678.25
    3,7-dimethyl-1-octanol 1879.34
    1-chlorooctane 1568.58
    1-chlorotetradecane 504.61
    n-nonane 384.95
    undecane 228.77
    tert-butylcyclohexane 839.59
    cyclooctane 718.05
    cyclopentanol 3200.02
    tetrahydropyran 12183.75
    tert-amyl methyl ether 6258.78
    2,5,8-trioxanonane 2610.05
    1-hexene 4523.47
    2-isopropoxyethanol 2178.27
    2,2,2-trifluoroethanol 285.41
    methyl butyrate 4282.81

    Scent© AI

1 of 3
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