5-methylidene-2-prop-1-en-2-ylhept-6-en-1-ol

  • Identifiers

    Molecular formula
    C11H18O

    SMILES
    CC(=C)C(CCC(=C)C=C)CO

  • Odor profile

    Fragrance
    Woody 50.84%
    Fresh 50.28%
    Citrus 49.33%
    Herbal 49.16%
    Fruity 43.54%
    Floral 43.41%
    Spicy 40.06%
    Sweet 37.25%
    Rose 36.48%
    Green 35.23%

     

    Flavor
    Herbal 29.18%
    Mouldy 22.48%
    Ocimene 22.42%
    Oriental 22.12%
    Spicy 22.02%
    Herb 21.77%
    Citrus 20.71%
    Fresh 20.65%
    Nitrile 20.65%
    Diterpene 20.46%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    3.6

    pKa est.
    8.56 (weak base)

    Molecular weight
    166.26 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    232°C

    Flash point

    • 94.1 ˚C est.

  • Applications

    5-methylidene-2-prop-1-en-2-ylhept-6-en-1-ol has practical applications mainly in the fragrance and cosmetic sectors: it can serve as a fragrance ingredient in perfume and personal care products; it may be used as a flavor precursor or aroma-active additive in the food and beverage industry; it finds use in household products such as air fresheners and cleaners as a fragrance additive; it can act as an intermediate for the synthesis of other fragrance compounds or as a building block for polymer, coating and ink formulations; and it may be considered as a chemical intermediate for specialty applications.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2005.74
    methanol 1571.86
    isopropanol 1488.08
    water 1.32
    ethyl acetate 1105.41
    n-propanol 1697.02
    acetone 759.82
    n-butanol 1691.47
    acetonitrile 795.62
    DMF 535.12
    toluene 264.23
    isobutanol 1005.58
    1,4-dioxane 2014.31
    methyl acetate 694.33
    THF 2169.06
    2-butanone 906.16
    n-pentanol 815.53
    sec-butanol 1190.24
    n-hexane 93.98
    ethylene glycol 127.2
    NMP 392.7
    cyclohexane 195.57
    DMSO 667.36
    n-butyl acetate 780.31
    n-octanol 226.95
    chloroform 988.64
    n-propyl acetate 523.92
    acetic acid 740.19
    dichloromethane 753.65
    cyclohexanone 925.76
    propylene glycol 293.3
    isopropyl acetate 483.76
    DMAc 414.8
    2-ethoxyethanol 804.05
    isopentanol 1171.9
    n-heptane 94.28
    ethyl formate 517.82
    1,2-dichloroethane 557.89
    n-hexanol 989.92
    2-methoxyethanol 1372.25
    isobutyl acetate 271.16
    tetrachloromethane 194.99
    n-pentyl acetate 267.52
    transcutol 2037.22
    n-heptanol 311.47
    ethylbenzene 114.98
    MIBK 380.66
    2-propoxyethanol 994.39
    tert-butanol 1502.81
    MTBE 1079.86
    2-butoxyethanol 443.55
    propionic acid 580.58
    o-xylene 149.15
    formic acid 210.46
    diethyl ether 1465.23
    m-xylene 185.73
    p-xylene 149.28
    chlorobenzene 286.14
    dimethyl carbonate 108.42
    n-octane 21.17
    formamide 326.1
    cyclopentanone 781.92
    2-pentanone 819.64
    anisole 294.46
    cyclopentyl methyl ether 826.77
    gamma-butyrolactone 808.16
    1-methoxy-2-propanol 940.31
    pyridine 948.13
    3-pentanone 464.47
    furfural 650.05
    n-dodecane 11.51
    diethylene glycol 487.68
    diisopropyl ether 286.79
    tert-amyl alcohol 1064.32
    acetylacetone 436.57
    n-hexadecane 13.34
    acetophenone 217.64
    methyl propionate 490.23
    isopentyl acetate 581.96
    trichloroethylene 861.04
    n-nonanol 193.02
    cyclohexanol 902.01
    benzyl alcohol 257.67
    2-ethylhexanol 489.57
    isooctanol 224.47
    dipropyl ether 690.75
    1,2-dichlorobenzene 217.03
    ethyl lactate 159.12
    propylene carbonate 439.11
    n-methylformamide 445.18
    2-pentanol 978.37
    n-pentane 123.52
    1-propoxy-2-propanol 756.49
    1-methoxy-2-propyl acetate 511.87
    2-(2-methoxypropoxy) propanol 323.27
    mesitylene 117.52
    ε-caprolactone 764.07
    p-cymene 103.3
    epichlorohydrin 1020.23
    1,1,1-trichloroethane 506.92
    2-aminoethanol 469.35
    morpholine-4-carbaldehyde 638.54
    sulfolane 543.83
    2,2,4-trimethylpentane 53.29
    2-methyltetrahydrofuran 1693.44
    n-hexyl acetate 335.48
    isooctane 47.08
    2-(2-butoxyethoxy)ethanol 521.83
    sec-butyl acetate 327.49
    tert-butyl acetate 448.25
    decalin 50.29
    glycerin 301.46
    diglyme 969.6
    acrylic acid 320.16
    isopropyl myristate 111.46
    n-butyric acid 1182.65
    acetyl acetate 351.39
    di(2-ethylhexyl) phthalate 109.77
    ethyl propionate 353.88
    nitromethane 792.2
    1,2-diethoxyethane 821.85
    benzonitrile 320.03
    trioctyl phosphate 79.86
    1-bromopropane 450.9
    gamma-valerolactone 1066.49
    n-decanol 128.99
    triethyl phosphate 134.93
    4-methyl-2-pentanol 404.67
    propionitrile 742.61
    vinylene carbonate 362.79
    1,1,2-trichlorotrifluoroethane 512.72
    DMS 164.11
    cumene 85.34
    2-octanol 171.95
    2-hexanone 536.55
    octyl acetate 139.16
    limonene 203.4
    1,2-dimethoxyethane 1221.55
    ethyl orthosilicate 160.69
    tributyl phosphate 104.47
    diacetone alcohol 471.52
    N,N-dimethylaniline 162.01
    acrylonitrile 559.36
    aniline 457.82
    1,3-propanediol 849.4
    bromobenzene 245.97
    dibromomethane 575.9
    1,1,2,2-tetrachloroethane 697.25
    2-methyl-cyclohexyl acetate 272.15
    tetrabutyl urea 119.55
    diisobutyl methanol 249.06
    2-phenylethanol 303.01
    styrene 149.87
    dioctyl adipate 158.27
    dimethyl sulfate 134.57
    ethyl butyrate 532.67
    methyl lactate 176.14
    butyl lactate 198.81
    diethyl carbonate 262.82
    propanediol butyl ether 323.54
    triethyl orthoformate 334.38
    p-tert-butyltoluene 104.85
    methyl 4-tert-butylbenzoate 192.2
    morpholine 2573.18
    tert-butylamine 995.48
    n-dodecanol 91.2
    dimethoxymethane 545.46
    ethylene carbonate 362.66
    cyrene 226.47
    2-ethoxyethyl acetate 340.81
    2-ethylhexyl acetate 419.35
    1,2,4-trichlorobenzene 242.76
    4-methylpyridine 715.37
    dibutyl ether 319.43
    2,6-dimethyl-4-heptanol 249.06
    DEF 642.67
    dimethyl isosorbide 486.79
    tetrachloroethylene 524.84
    eugenol 197.68
    triacetin 229.27
    span 80 307.45
    1,4-butanediol 216.8
    1,1-dichloroethane 629.88
    2-methyl-1-pentanol 564.64
    methyl formate 256.5
    2-methyl-1-butanol 988.75
    n-decane 24.98
    butyronitrile 986.35
    3,7-dimethyl-1-octanol 225.26
    1-chlorooctane 109.67
    1-chlorotetradecane 33.74
    n-nonane 25.76
    undecane 15.87
    tert-butylcyclohexane 50.05
    cyclooctane 50.04
    cyclopentanol 723.19
    tetrahydropyran 2396.11
    tert-amyl methyl ether 616.18
    2,5,8-trioxanonane 532.63
    1-hexene 370.51
    2-isopropoxyethanol 471.91
    2,2,2-trifluoroethanol 138.08
    methyl butyrate 506.6

    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