1-(2,2-Diethoxyethoxy)-3,7-dimethylocta-2,6-diene

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  • Identifiers

    Molecular formula
    C16H30O3

    SMILES
    CCOC(COCC=C(C)CCC=C(C)C)OCC

  • Odor profile

    Floral 70.18%
    Green 59.55%
    Sweet 56.25%
    Fresh 50.69%
    Rose 49.26%
    Citrus 48.87%
    Waxy 39.3%
    Lemon 38.72%
    Lily 37.02%
    Muguet 34.85%

    Scent© AI

  • Properties

    XLogP3-AA
    4.0

    pKa est.
    7.62 (neutral)

    Molecular weight
    270.41 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    284°C

    Flash point est.
    110.55 ˚C

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 402.0
    methanol 291.26
    isopropanol 362.78
    water 0.34
    ethyl acetate 767.61
    n-propanol 438.92
    acetone 508.65
    n-butanol 491.73
    acetonitrile 382.56
    DMF 267.59
    toluene 569.51
    isobutanol 352.88
    1,4-dioxane 1109.46
    methyl acetate 467.22
    THF 1227.67
    2-butanone 546.73
    n-pentanol 440.11
    sec-butanol 521.7
    n-hexane 363.84
    ethylene glycol 32.07
    NMP 433.43
    cyclohexane 1062.45
    DMSO 617.15
    n-butyl acetate 607.08
    n-octanol 236.75
    chloroform 2955.88
    n-propyl acetate 574.21
    acetic acid 481.56
    dichloromethane 2528.38
    cyclohexanone 1059.69
    propylene glycol 82.46
    isopropyl acetate 465.7
    DMAc 479.76
    2-ethoxyethanol 479.48
    isopentanol 425.89
    n-heptane 280.53
    ethyl formate 306.48
    1,2-dichloroethane 1396.33
    n-hexanol 474.35
    2-methoxyethanol 446.36
    isobutyl acetate 352.29
    tetrachloromethane 564.81
    n-pentyl acetate 473.25
    transcutol 1308.84
    n-heptanol 223.96
    ethylbenzene 357.65
    MIBK 328.13
    2-propoxyethanol 472.66
    tert-butanol 562.93
    MTBE 710.08
    2-butoxyethanol 328.29
    propionic acid 323.13
    o-xylene 386.89
    formic acid 82.1
    diethyl ether 947.52
    m-xylene 356.24
    p-xylene 469.79
    chlorobenzene 646.82
    dimethyl carbonate 113.36
    n-octane 85.04
    formamide 107.47
    cyclopentanone 691.15
    2-pentanone 516.08
    anisole 412.2
    cyclopentyl methyl ether 779.66
    gamma-butyrolactone 642.64
    1-methoxy-2-propanol 364.8
    pyridine 864.84
    3-pentanone 474.44
    furfural 568.04
    n-dodecane 44.31
    diethylene glycol 211.05
    diisopropyl ether 295.65
    tert-amyl alcohol 577.4
    acetylacetone 455.29
    n-hexadecane 51.69
    acetophenone 410.2
    methyl propionate 375.52
    isopentyl acetate 523.56
    trichloroethylene 2048.46
    n-nonanol 230.43
    cyclohexanol 806.3
    benzyl alcohol 338.16
    2-ethylhexanol 387.75
    isooctanol 206.89
    dipropyl ether 585.21
    1,2-dichlorobenzene 608.45
    ethyl lactate 199.46
    propylene carbonate 451.26
    n-methylformamide 140.05
    2-pentanol 426.89
    n-pentane 288.02
    1-propoxy-2-propanol 437.26
    1-methoxy-2-propyl acetate 402.9
    2-(2-methoxypropoxy) propanol 342.85
    mesitylene 237.34
    ε-caprolactone 830.25
    p-cymene 237.25
    epichlorohydrin 1023.96
    1,1,1-trichloroethane 1482.67
    2-aminoethanol 107.67
    morpholine-4-carbaldehyde 484.57
    sulfolane 709.34
    2,2,4-trimethylpentane 130.88
    2-methyltetrahydrofuran 1157.2
    n-hexyl acetate 553.42
    isooctane 68.6
    2-(2-butoxyethoxy)ethanol 452.38
    sec-butyl acetate 420.0
    tert-butyl acetate 463.27
    decalin 240.68
    glycerin 102.12
    diglyme 825.67
    acrylic acid 223.21
    isopropyl myristate 222.78
    n-butyric acid 589.86
    acetyl acetate 492.47
    di(2-ethylhexyl) phthalate 180.32
    ethyl propionate 467.26
    nitromethane 504.99
    1,2-diethoxyethane 688.69
    benzonitrile 410.76
    trioctyl phosphate 135.05
    1-bromopropane 1132.27
    gamma-valerolactone 756.92
    n-decanol 165.65
    triethyl phosphate 257.43
    4-methyl-2-pentanol 215.81
    propionitrile 377.69
    vinylene carbonate 392.6
    1,1,2-trichlorotrifluoroethane 633.57
    DMS 336.62
    cumene 228.4
    2-octanol 185.46
    2-hexanone 502.29
    octyl acetate 267.25
    limonene 386.09
    1,2-dimethoxyethane 828.57
    ethyl orthosilicate 277.72
    tributyl phosphate 176.51
    diacetone alcohol 354.83
    N,N-dimethylaniline 300.07
    acrylonitrile 304.9
    aniline 438.39
    1,3-propanediol 212.73
    bromobenzene 776.65
    dibromomethane 1972.51
    1,1,2,2-tetrachloroethane 1923.35
    2-methyl-cyclohexyl acetate 428.29
    tetrabutyl urea 209.48
    diisobutyl methanol 219.11
    2-phenylethanol 327.75
    styrene 416.08
    dioctyl adipate 322.55
    dimethyl sulfate 174.51
    ethyl butyrate 514.99
    methyl lactate 138.13
    butyl lactate 278.89
    diethyl carbonate 342.75
    propanediol butyl ether 258.69
    triethyl orthoformate 412.89
    p-tert-butyltoluene 212.29
    methyl 4-tert-butylbenzoate 336.47
    morpholine 1126.59
    tert-butylamine 454.86
    n-dodecanol 129.87
    dimethoxymethane 310.75
    ethylene carbonate 398.46
    cyrene 312.05
    2-ethoxyethyl acetate 471.44
    2-ethylhexyl acetate 477.86
    1,2,4-trichlorobenzene 666.06
    4-methylpyridine 732.7
    dibutyl ether 508.1
    2,6-dimethyl-4-heptanol 219.11
    DEF 507.72
    dimethyl isosorbide 526.2
    tetrachloroethylene 1291.4
    eugenol 291.76
    triacetin 471.05
    span 80 358.29
    1,4-butanediol 116.26
    1,1-dichloroethane 1364.32
    2-methyl-1-pentanol 412.87
    methyl formate 123.43
    2-methyl-1-butanol 443.45
    n-decane 93.25
    butyronitrile 467.24
    3,7-dimethyl-1-octanol 249.39
    1-chlorooctane 292.79
    1-chlorotetradecane 106.78
    n-nonane 98.87
    undecane 59.45
    tert-butylcyclohexane 170.61
    cyclooctane 269.95
    cyclopentanol 515.1
    tetrahydropyran 1723.32
    tert-amyl methyl ether 567.57
    2,5,8-trioxanonane 524.16
    1-hexene 621.75
    2-isopropoxyethanol 367.26
    2,2,2-trifluoroethanol 149.29
    methyl butyrate 582.78

    Scent© AI

1 3

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