1-Methoxy-2,7-octadiene

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  • Identifiers

    Molecular formula
    C9H16O

    SMILES
    COCC=CCCCC=C

  • Odor profile

    Green 74.15%
    Fruity 67.28%
    Fatty 66.58%
    Citrus 51.35%
    Melon 50.06%
    Fresh 50.04%
    Waxy 43.18%
    Cucumber 42.71%
    Aldehydic 40.05%
    Herbal 34.34%

    Scent© AI

  • Properties

    XLogP3-AA
    2.5

    Molecular weight
    140.22 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very fast

    Boiling point est.
    167°C

    Flash point est.
    50.89 ˚C

  • Synonyms

    • 1-methoxy-2,7-octadiene
    • 8-methoxyocta-1,6-diene
    • DTXSID401035969
    • methoxy-2,7-octadiene
    • 8-methoxy-1,6-octadiene
    • DTXCID80287711
    • MIJJHRIQVWIQGL-UHFFFAOYSA-N
    • NS00002829

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2761.44
    methanol 2045.07
    isopropanol 2167.08
    water 0.36
    ethyl acetate 1924.85
    n-propanol 2268.86
    acetone 1856.29
    n-butanol 2272.07
    acetonitrile 1167.75
    DMF 1037.04
    toluene 611.79
    isobutanol 1506.12
    1,4-dioxane 2595.51
    methyl acetate 1343.71
    THF 3033.77
    2-butanone 1483.17
    n-pentanol 1298.77
    sec-butanol 1940.38
    n-hexane 625.85
    ethylene glycol 353.5
    NMP 695.58
    cyclohexane 1148.95
    DMSO 2000.83
    n-butyl acetate 1541.95
    n-octanol 392.85
    chloroform 2957.64
    n-propyl acetate 968.76
    acetic acid 1574.61
    dichloromethane 2674.5
    cyclohexanone 1697.28
    propylene glycol 692.25
    isopropyl acetate 813.33
    DMAc 603.78
    2-ethoxyethanol 1292.19
    isopentanol 1518.85
    n-heptane 577.82
    ethyl formate 750.46
    1,2-dichloroethane 1953.65
    n-hexanol 1699.98
    2-methoxyethanol 2094.55
    isobutyl acetate 505.33
    tetrachloromethane 698.8
    n-pentyl acetate 508.36
    transcutol 3331.1
    n-heptanol 454.75
    ethylbenzene 294.81
    MIBK 606.49
    2-propoxyethanol 1706.07
    tert-butanol 2397.85
    MTBE 1815.76
    2-butoxyethanol 664.97
    propionic acid 1157.0
    o-xylene 323.04
    formic acid 268.38
    diethyl ether 2660.67
    m-xylene 364.79
    p-xylene 316.22
    chlorobenzene 696.43
    dimethyl carbonate 216.91
    n-octane 115.94
    formamide 319.01
    cyclopentanone 1356.71
    2-pentanone 1336.24
    anisole 499.88
    cyclopentyl methyl ether 1567.85
    gamma-butyrolactone 1305.45
    1-methoxy-2-propanol 1487.61
    pyridine 1658.28
    3-pentanone 867.06
    furfural 1002.51
    n-dodecane 55.98
    diethylene glycol 979.94
    diisopropyl ether 579.28
    tert-amyl alcohol 1695.93
    acetylacetone 898.68
    n-hexadecane 62.77
    acetophenone 374.47
    methyl propionate 990.04
    isopentyl acetate 1003.21
    trichloroethylene 2732.33
    n-nonanol 334.39
    cyclohexanol 1748.15
    benzyl alcohol 462.05
    2-ethylhexanol 939.17
    isooctanol 355.76
    dipropyl ether 1505.43
    1,2-dichlorobenzene 526.52
    ethyl lactate 321.01
    propylene carbonate 806.46
    n-methylformamide 611.58
    2-pentanol 1565.12
    n-pentane 707.63
    1-propoxy-2-propanol 1415.05
    1-methoxy-2-propyl acetate 846.67
    2-(2-methoxypropoxy) propanol 494.43
    mesitylene 236.93
    ε-caprolactone 1294.25
    p-cymene 252.98
    epichlorohydrin 1890.63
    1,1,1-trichloroethane 1803.61
    2-aminoethanol 850.67
    morpholine-4-carbaldehyde 996.48
    sulfolane 1288.26
    2,2,4-trimethylpentane 175.49
    2-methyltetrahydrofuran 2596.45
    n-hexyl acetate 628.97
    isooctane 154.45
    2-(2-butoxyethoxy)ethanol 790.69
    sec-butyl acetate 546.75
    tert-butyl acetate 765.09
    decalin 212.88
    glycerin 589.44
    diglyme 1476.63
    acrylic acid 680.47
    isopropyl myristate 231.78
    n-butyric acid 1978.73
    acetyl acetate 670.71
    di(2-ethylhexyl) phthalate 181.19
    ethyl propionate 708.54
    nitromethane 1373.29
    1,2-diethoxyethane 1453.18
    benzonitrile 550.24
    trioctyl phosphate 145.05
    1-bromopropane 1955.29
    gamma-valerolactone 1495.7
    n-decanol 241.86
    triethyl phosphate 266.87
    4-methyl-2-pentanol 612.5
    propionitrile 1170.46
    vinylene carbonate 657.67
    1,1,2-trichlorotrifluoroethane 1270.49
    DMS 383.75
    cumene 184.5
    2-octanol 282.04
    2-hexanone 872.96
    octyl acetate 276.63
    limonene 517.63
    1,2-dimethoxyethane 1700.12
    ethyl orthosilicate 314.37
    tributyl phosphate 200.04
    diacetone alcohol 740.66
    N,N-dimethylaniline 283.65
    acrylonitrile 994.86
    aniline 757.92
    1,3-propanediol 1152.44
    bromobenzene 730.54
    dibromomethane 2275.15
    1,1,2,2-tetrachloroethane 2285.92
    2-methyl-cyclohexyl acetate 480.88
    tetrabutyl urea 235.09
    diisobutyl methanol 498.69
    2-phenylethanol 519.76
    styrene 401.75
    dioctyl adipate 309.42
    dimethyl sulfate 287.81
    ethyl butyrate 956.06
    methyl lactate 353.5
    butyl lactate 358.29
    diethyl carbonate 497.46
    propanediol butyl ether 521.11
    triethyl orthoformate 582.53
    p-tert-butyltoluene 246.0
    methyl 4-tert-butylbenzoate 316.1
    morpholine 3196.14
    tert-butylamine 1759.68
    n-dodecanol 188.2
    dimethoxymethane 1025.26
    ethylene carbonate 634.34
    cyrene 344.04
    2-ethoxyethyl acetate 623.52
    2-ethylhexyl acetate 773.38
    1,2,4-trichlorobenzene 596.46
    4-methylpyridine 1200.62
    dibutyl ether 828.9
    2,6-dimethyl-4-heptanol 498.69
    DEF 1120.49
    dimethyl isosorbide 706.66
    tetrachloroethylene 1591.78
    eugenol 315.17
    triacetin 485.3
    span 80 524.82
    1,4-butanediol 433.34
    1,1-dichloroethane 2117.68
    2-methyl-1-pentanol 903.52
    methyl formate 413.93
    2-methyl-1-butanol 1415.28
    n-decane 112.67
    butyronitrile 1465.19
    3,7-dimethyl-1-octanol 434.38
    1-chlorooctane 318.05
    1-chlorotetradecane 111.52
    n-nonane 134.59
    undecane 74.93
    tert-butylcyclohexane 182.89
    cyclooctane 292.99
    cyclopentanol 1390.74
    tetrahydropyran 3759.98
    tert-amyl methyl ether 1086.28
    2,5,8-trioxanonane 836.75
    1-hexene 1345.47
    2-isopropoxyethanol 849.61
    2,2,2-trifluoroethanol 265.23
    methyl butyrate 966.7

    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