3-Nonene, 9,9-dimethoxy-, (3Z)-

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  • Identifiers

    CAS number
    68555-53-3

    Molecular formula
    C11H22O2

    SMILES
    CC/C=C\CCCCC(OC)OC

  • Odor profile

    Fragrance
    Green 82.15%
    Fruity 68.44%
    Citrus 55.73%
    Melon 54.29%
    Fresh 54.02%
    Waxy 53.29%
    Fatty 49.35%
    Cucumber 46.03%
    Apple 41.04%
    Herbal 38.92%

     

    Flavor
    Green 44.55%
    Waxy 42.9%
    Fruity 38.43%
    Fresh 37.21%
    Floral 32.44%
    Melon 31.86%
    Tropical 31.54%
    Rose 28.29%
    Oily 24.16%
    Clean 23.35%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    3.1

    pKa est.
    7.73 (neutral)

    Molecular weight
    186.29 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderate

    Boiling point est.
    214°C

    Flash point

    • 77.97 ˚C est.

  • Synonyms

    • 68555-53-3
    • cis-6-Nonen-1-al dimethyl acetal
    • cis-6-Nonenal dimethyl acetal
    • (Z)-9,9-Dimethoxynon-3-ene
    • cis-6-NONENAL DIMETHYLACETAL
    • 3-Nonene, 9,9-dimethoxy-, (Z)-
    • 3-Nonene, 9,9-dimethoxy-, (3Z)-
    • EINECS 271-429-0
    • DTXSID70887461
    • SCHEMBL3505336
    • UVCRVXVBFFMDFR-WAYWQWQTSA-N
    • DTXCID101026755
    • AKOS006274032
    • DB-307761
    • NS00064226

  • Applications

    For 3-Nonene, 9,9-dimethoxy-, (3Z)- (CAS 68555-53-3), this is a specialty organic intermediate that can be used as a building block in organic synthesis; in fragrance chemistry it may serve as a fragrance precursor or fixative; in cosmetics and personal care it can be used as a solvent or formulation aid; in coatings and inks it can function as a processing solvent or viscosity modifier; in polymers and plastics it may act as a monomer modifier or plasticizer; and in industrial manufacturing it can serve as a processing aid or chemical intermediate.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 5033.75
    methanol 3987.27
    isopropanol 4377.87
    water 0.37
    ethyl acetate 5525.06
    n-propanol 4559.34
    acetone 4099.87
    n-butanol 4629.98
    acetonitrile 4016.58
    DMF 1811.17
    toluene 2340.98
    isobutanol 3378.16
    1,4-dioxane 6744.01
    methyl acetate 3080.18
    THF 6530.4
    2-butanone 3714.05
    n-pentanol 3237.43
    sec-butanol 4580.9
    n-hexane 2657.55
    ethylene glycol 321.03
    NMP 1495.65
    cyclohexane 5009.22
    DMSO 3252.74
    n-butyl acetate 4675.07
    n-octanol 1276.96
    chloroform 11198.89
    n-propyl acetate 3587.24
    acetic acid 2709.38
    dichloromethane 10781.6
    cyclohexanone 4912.13
    propylene glycol 606.55
    isopropyl acetate 3237.34
    DMAc 1509.53
    2-ethoxyethanol 2955.1
    isopentanol 3829.11
    n-heptane 1677.87
    ethyl formate 2122.3
    1,2-dichloroethane 6459.07
    n-hexanol 3582.5
    2-methoxyethanol 3478.12
    isobutyl acetate 1806.59
    tetrachloromethane 2955.64
    n-pentyl acetate 2268.9
    transcutol 5946.2
    n-heptanol 1257.89
    ethylbenzene 1260.89
    MIBK 2010.54
    2-propoxyethanol 3189.56
    tert-butanol 6185.5
    MTBE 6530.14
    2-butoxyethanol 1694.09
    propionic acid 2060.87
    o-xylene 1231.1
    formic acid 446.25
    diethyl ether 9485.08
    m-xylene 1327.45
    p-xylene 1517.93
    chlorobenzene 2432.56
    dimethyl carbonate 488.63
    n-octane 456.73
    formamide 619.42
    cyclopentanone 3232.77
    2-pentanone 3727.65
    anisole 1721.95
    cyclopentyl methyl ether 4579.36
    gamma-butyrolactone 2830.18
    1-methoxy-2-propanol 2611.21
    pyridine 4371.71
    3-pentanone 2556.66
    furfural 2205.69
    n-dodecane 202.5
    diethylene glycol 1360.81
    diisopropyl ether 2286.42
    tert-amyl alcohol 4992.63
    acetylacetone 2330.94
    n-hexadecane 235.93
    acetophenone 1285.14
    methyl propionate 2288.35
    isopentyl acetate 3225.83
    trichloroethylene 8630.46
    n-nonanol 1085.82
    cyclohexanol 4799.77
    benzyl alcohol 1362.97
    2-ethylhexanol 2438.5
    isooctanol 1132.89
    dipropyl ether 4265.63
    1,2-dichlorobenzene 1944.88
    ethyl lactate 765.19
    propylene carbonate 1892.93
    n-methylformamide 1111.34
    2-pentanol 3992.02
    n-pentane 2521.28
    1-propoxy-2-propanol 2877.78
    1-methoxy-2-propyl acetate 2076.87
    2-(2-methoxypropoxy) propanol 1033.87
    mesitylene 914.51
    ε-caprolactone 4006.1
    p-cymene 857.45
    epichlorohydrin 4799.05
    1,1,1-trichloroethane 7082.14
    2-aminoethanol 983.89
    morpholine-4-carbaldehyde 2211.13
    sulfolane 2629.0
    2,2,4-trimethylpentane 691.75
    2-methyltetrahydrofuran 7367.08
    n-hexyl acetate 2319.78
    isooctane 539.07
    2-(2-butoxyethoxy)ethanol 1591.15
    sec-butyl acetate 2306.66
    tert-butyl acetate 2923.15
    decalin 910.18
    glycerin 601.39
    diglyme 3343.37
    acrylic acid 1234.47
    isopropyl myristate 748.56
    n-butyric acid 4258.29
    acetyl acetate 2254.54
    di(2-ethylhexyl) phthalate 514.92
    ethyl propionate 2532.67
    nitromethane 3044.37
    1,2-diethoxyethane 4256.71
    benzonitrile 1984.04
    trioctyl phosphate 423.19
    1-bromopropane 6794.89
    gamma-valerolactone 3435.76
    n-decanol 709.75
    triethyl phosphate 790.4
    4-methyl-2-pentanol 1738.93
    propionitrile 3633.4
    vinylene carbonate 1559.83
    1,1,2-trichlorotrifluoroethane 2821.05
    DMS 1023.07
    cumene 756.01
    2-octanol 1019.93
    2-hexanone 2982.55
    octyl acetate 867.19
    limonene 1637.85
    1,2-dimethoxyethane 4756.77
    ethyl orthosilicate 975.53
    tributyl phosphate 590.14
    diacetone alcohol 1905.5
    N,N-dimethylaniline 1014.22
    acrylonitrile 2676.01
    aniline 2174.94
    1,3-propanediol 1745.13
    bromobenzene 2954.92
    dibromomethane 8587.88
    1,1,2,2-tetrachloroethane 7524.95
    2-methyl-cyclohexyl acetate 1424.12
    tetrabutyl urea 650.58
    diisobutyl methanol 1265.11
    2-phenylethanol 1346.81
    styrene 1693.34
    dioctyl adipate 914.77
    dimethyl sulfate 633.35
    ethyl butyrate 3067.65
    methyl lactate 593.34
    butyl lactate 1065.08
    diethyl carbonate 1480.69
    propanediol butyl ether 1082.08
    triethyl orthoformate 1833.51
    p-tert-butyltoluene 814.41
    methyl 4-tert-butylbenzoate 914.87
    morpholine 7655.79
    tert-butylamine 5372.06
    n-dodecanol 516.47
    dimethoxymethane 2078.64
    ethylene carbonate 1697.66
    cyrene 782.55
    2-ethoxyethyl acetate 2063.85
    2-ethylhexyl acetate 2598.3
    1,2,4-trichlorobenzene 2059.74
    4-methylpyridine 3982.16
    dibutyl ether 2957.82
    2,6-dimethyl-4-heptanol 1265.11
    DEF 3204.12
    dimethyl isosorbide 1531.2
    tetrachloroethylene 5297.87
    eugenol 843.19
    triacetin 1337.55
    span 80 1121.53
    1,4-butanediol 825.85
    1,1-dichloroethane 7433.67
    2-methyl-1-pentanol 2747.94
    methyl formate 803.9
    2-methyl-1-butanol 3769.67
    n-decane 442.12
    butyronitrile 4900.43
    3,7-dimethyl-1-octanol 1316.35
    1-chlorooctane 1290.76
    1-chlorotetradecane 388.46
    n-nonane 529.05
    undecane 275.11
    tert-butylcyclohexane 777.27
    cyclooctane 1266.01
    cyclopentanol 3177.64
    tetrahydropyran 10529.5
    tert-amyl methyl ether 3889.8
    2,5,8-trioxanonane 1717.4
    1-hexene 5080.29
    2-isopropoxyethanol 2244.92
    2,2,2-trifluoroethanol 594.75
    methyl butyrate 3513.15

    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