3-(4-Methyl-3-cyclohexen-1-yl)-3-butenol

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  • Identifiers

    CAS number
    15766-66-2

    Molecular formula
    C11H18O

    SMILES
    CC1=CCC(CC1)C(=C)CCO

    Safety labels

  • Odor profile

    Fragrance
    Floral 77.51%
    Sweet 56.1%
    Fruity 53.51%
    Green 50.9%
    Fresh 49.03%
    Rose 48.48%
    Herbal 47.75%
    Citrus 43.71%
    Woody 42.52%
    Waxy 39.85%

     

    Flavor
    Herbal 42.06%
    Woody 34.43%
    Fresh 32.88%
    Spicy 32.84%
    Floral 32.14%
    Sweet 31.35%
    Green 30.66%
    Minty 30.6%
    Mint 30.25%
    Spice 29.53%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    2.6

    pKa est.
    9.02 (weak base)

    Molecular weight
    166.26 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very slow

    Boiling point est.
    256°C

    Flash point

    • 107.74 ˚C est.

  • Synonyms

    • 15766-66-2
    • 3-(4-Methyl-3-cyclohexen-1-yl)-3-buten-1-ol
    • EINECS 239-857-2
    • 3-Cyclohexene-1-propanol, 4-methyl-gamma-methylene-
    • 3-Cyclohexene-1-propanol, 4-methyl-.gamma.-methylene-
    • 3-(4-Methyl-3-cyclohexen-1-yl)-3-butenol
    • 9317W64J9I
    • DTXSID70864636
    • 10-HYDROXY-1,8-P-MENTHADIENE
    • 4-METHYL-.GAMMA.-METHYLENE-3-CYCLOHEXENE-1-PROPANOL
    • RefChem:493282
    • DTXCID00813132
    • 4-METHYL-GAMMA-METHYLENE-3-CYCLOHEXENE-1-PROPANOL
    • 3-(4-METHYL-3-CYCLOHEXEN-1-YL)-3-BUTENOL, (+-)-
    • 3-(4-methylcyclohex-3-en-1-yl)but-3-en-1-ol
    • 4-Methyl-gamma-methylenecyclohex-3-ene-1-propan-1-ol
    • SCHEMBL11289934
    • UNII-9317W64J9I
    • KGQKYMFFMFUSOZ-UHFFFAOYSA-N
    • AKOS006345512
    • NS00012638
    • 3-(4-methyl-1-cyclohex-3-enyl)-but-3-en-1-ol
    • Q27271541
    • 3-(4-METHYL-3-CYCLOHEXEN-1-YL)-3-BUTENOL, (+/-)-
    • 15766-66-2

  • Applications

    3-(4-Methyl-3-cyclohexen-1-yl)-3-butenol is primarily used as a fragrance component and synthetic precursor in the perfume and cosmetics industries, serving as an odorant or building block for the synthesis of terpenoid scent compounds. It is also considered as a potential intermediate for fragrance and aroma-related derivatives in the flavor/aroma field. In industrial manufacturing, it may act as an intermediate for the synthesis of specialty fragrance ingredients and related terpenoid derivatives. It may be used as an odorant additive in household and consumer cleaning products, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 8028.58
    methanol 4399.79
    isopropanol 8149.48
    water 0.94
    ethyl acetate 4013.81
    n-propanol 6831.84
    acetone 4166.17
    n-butanol 5483.48
    acetonitrile 3680.49
    DMF 2233.91
    toluene 859.37
    isobutanol 4198.04
    1,4-dioxane 6952.02
    methyl acetate 2708.25
    THF 6424.84
    2-butanone 3147.97
    n-pentanol 2098.37
    sec-butanol 3945.93
    n-hexane 97.65
    ethylene glycol 563.21
    NMP 578.81
    cyclohexane 312.2
    DMSO 2400.67
    n-butyl acetate 1687.97
    n-octanol 426.25
    chloroform 3070.81
    n-propyl acetate 1089.44
    acetic acid 1910.56
    dichloromethane 2630.96
    cyclohexanone 2161.79
    propylene glycol 1333.02
    isopropyl acetate 1701.1
    DMAc 897.08
    2-ethoxyethanol 2213.05
    isopentanol 3455.72
    n-heptane 127.45
    ethyl formate 1564.36
    1,2-dichloroethane 1891.88
    n-hexanol 2611.33
    2-methoxyethanol 5370.42
    isobutyl acetate 530.1
    tetrachloromethane 468.52
    n-pentyl acetate 500.17
    transcutol 5224.54
    n-heptanol 585.52
    ethylbenzene 212.2
    MIBK 1130.65
    2-propoxyethanol 3275.7
    tert-butanol 6906.65
    MTBE 3923.4
    2-butoxyethanol 1054.17
    propionic acid 1733.32
    o-xylene 303.67
    formic acid 467.24
    diethyl ether 4608.38
    m-xylene 517.34
    p-xylene 235.94
    chlorobenzene 686.11
    dimethyl carbonate 418.74
    n-octane 31.91
    formamide 891.59
    cyclopentanone 2104.15
    2-pentanone 2722.39
    anisole 601.03
    cyclopentyl methyl ether 2091.62
    gamma-butyrolactone 2007.28
    1-methoxy-2-propanol 3843.57
    pyridine 2461.84
    3-pentanone 1281.38
    furfural 1216.61
    n-dodecane 20.99
    diethylene glycol 1542.41
    diisopropyl ether 784.66
    tert-amyl alcohol 2788.72
    acetylacetone 1509.78
    n-hexadecane 24.5
    acetophenone 351.22
    methyl propionate 1800.44
    isopentyl acetate 1180.49
    trichloroethylene 2536.13
    n-nonanol 345.61
    cyclohexanol 2266.66
    benzyl alcohol 555.72
    2-ethylhexanol 801.3
    isooctanol 386.35
    dipropyl ether 1430.65
    1,2-dichlorobenzene 410.77
    ethyl lactate 311.33
    propylene carbonate 922.54
    n-methylformamide 1771.58
    2-pentanol 3031.19
    n-pentane 217.12
    1-propoxy-2-propanol 2174.59
    1-methoxy-2-propyl acetate 1376.58
    2-(2-methoxypropoxy) propanol 564.08
    mesitylene 262.33
    ε-caprolactone 1548.35
    p-cymene 166.67
    epichlorohydrin 3033.33
    1,1,1-trichloroethane 1588.95
    2-aminoethanol 2043.7
    morpholine-4-carbaldehyde 1464.95
    sulfolane 1066.61
    2,2,4-trimethylpentane 69.99
    2-methyltetrahydrofuran 4189.9
    n-hexyl acetate 635.34
    isooctane 89.0
    2-(2-butoxyethoxy)ethanol 1096.64
    sec-butyl acetate 593.24
    tert-butyl acetate 1301.85
    decalin 63.58
    glycerin 967.13
    diglyme 2144.66
    acrylic acid 850.75
    isopropyl myristate 197.54
    n-butyric acid 3343.41
    acetyl acetate 982.1
    di(2-ethylhexyl) phthalate 164.44
    ethyl propionate 752.24
    nitromethane 2541.28
    1,2-diethoxyethane 2298.16
    benzonitrile 702.14
    trioctyl phosphate 128.83
    1-bromopropane 1448.23
    gamma-valerolactone 2742.09
    n-decanol 242.25
    triethyl phosphate 193.58
    4-methyl-2-pentanol 1056.87
    propionitrile 2744.35
    vinylene carbonate 768.3
    1,1,2-trichlorotrifluoroethane 1175.96
    DMS 361.24
    cumene 136.17
    2-octanol 306.03
    2-hexanone 997.22
    octyl acetate 249.55
    limonene 314.68
    1,2-dimethoxyethane 2959.83
    ethyl orthosilicate 230.1
    tributyl phosphate 165.02
    diacetone alcohol 1327.93
    N,N-dimethylaniline 264.26
    acrylonitrile 1912.17
    aniline 1314.82
    1,3-propanediol 3409.8
    bromobenzene 620.31
    dibromomethane 1740.73
    1,1,2,2-tetrachloroethane 1884.94
    2-methyl-cyclohexyl acetate 346.89
    tetrabutyl urea 177.66
    diisobutyl methanol 431.19
    2-phenylethanol 638.27
    styrene 296.14
    dioctyl adipate 245.52
    dimethyl sulfate 343.87
    ethyl butyrate 901.88
    methyl lactate 540.04
    butyl lactate 348.06
    diethyl carbonate 437.28
    propanediol butyl ether 740.51
    triethyl orthoformate 508.15
    p-tert-butyltoluene 179.82
    methyl 4-tert-butylbenzoate 305.21
    morpholine 8587.62
    tert-butylamine 3981.99
    n-dodecanol 175.94
    dimethoxymethane 2665.44
    ethylene carbonate 845.62
    cyrene 311.66
    2-ethoxyethyl acetate 821.15
    2-ethylhexyl acetate 722.86
    1,2,4-trichlorobenzene 465.88
    4-methylpyridine 1839.56
    dibutyl ether 636.47
    2,6-dimethyl-4-heptanol 431.19
    DEF 1533.64
    dimethyl isosorbide 767.53
    tetrachloroethylene 1164.58
    eugenol 301.12
    triacetin 416.11
    span 80 510.26
    1,4-butanediol 687.14
    1,1-dichloroethane 2681.28
    2-methyl-1-pentanol 1054.89
    methyl formate 998.09
    2-methyl-1-butanol 2524.77
    n-decane 41.48
    butyronitrile 3158.93
    3,7-dimethyl-1-octanol 416.69
    1-chlorooctane 193.32
    1-chlorotetradecane 62.36
    n-nonane 41.46
    undecane 28.27
    tert-butylcyclohexane 64.7
    cyclooctane 73.82
    cyclopentanol 2145.23
    tetrahydropyran 6730.68
    tert-amyl methyl ether 1411.04
    2,5,8-trioxanonane 1022.28
    1-hexene 566.12
    2-isopropoxyethanol 1199.22
    2,2,2-trifluoroethanol 333.83
    methyl butyrate 1007.01

    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