3-but-3-en-2-ylcyclohexene;methanol

  • Identifiers

    Molecular formula
    C11H20O

    SMILES
    CC(C=C)C1CCCC=C1.CO

  • Odor profile

    Fragrance
    Herbal 66.48%
    Citrus 59.77%
    Green 55.23%
    Woody 51.46%
    Spicy 50.14%
    Fresh 44.7%
    Terpenic 38.75%
    Oily 33.76%
    Aldehydic 31.33%
    Pine 31.18%

     

    Flavor
    Spice 29.95%
    Woody 27.91%
    Herbal 26.42%
    Wood 25.59%
    Terpentine 23.28%
    Citric 20.44%
    Low 20.38%
    Diterpene 20.3%
    Citrus 20.19%
    Herb 20.18%

     

    Odor impact est.
    High

  • Properties

    pKa est.
    8.33 (weak base)

    Molecular weight
    168.28 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very fast

    Boiling point est.
    163°C

    Flash point

    • 47.56 ˚C est.

  • Applications

    3-but-3-en-2-ylcyclohexene;methanol may serve as a synthetic intermediate in fragrance and cosmetic ingredient development, providing a building block for aroma compounds or scent formulations. It can also function as a precursor in polymers and plastics, contributing to functional monomer or additive roles in certain resin systems. In coatings and inks, it may act as a monomer or processing aid for formulations such as UV-curable systems. Additionally, 3-but-3-en-2-ylcyclohexene;methanol could be considered as an industrial intermediate or solvent component in formulation workflows, depending on local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1028.42
    methanol 316.61
    isopropanol 1242.39
    water 0.04
    ethyl acetate 1407.89
    n-propanol 1077.65
    acetone 1179.95
    n-butanol 1349.03
    acetonitrile 949.22
    DMF 615.99
    toluene 1281.26
    isobutanol 942.51
    1,4-dioxane 2146.41
    methyl acetate 1020.05
    THF 3503.8
    2-butanone 1436.32
    n-pentanol 813.56
    sec-butanol 1216.14
    n-hexane 1020.42
    ethylene glycol 42.77
    NMP 503.11
    cyclohexane 1546.96
    DMSO 880.95
    n-butyl acetate 2956.45
    n-octanol 634.2
    chloroform 2260.63
    n-propyl acetate 887.55
    acetic acid 320.78
    dichloromethane 2384.68
    cyclohexanone 1637.22
    propylene glycol 117.39
    isopropyl acetate 881.02
    DMAc 459.74
    2-ethoxyethanol 474.09
    isopentanol 1160.58
    n-heptane 1718.0
    ethyl formate 620.02
    1,2-dichloroethane 1697.19
    n-hexanol 2417.98
    2-methoxyethanol 686.28
    isobutyl acetate 558.58
    tetrachloromethane 691.04
    n-pentyl acetate 787.76
    transcutol 1969.13
    n-heptanol 686.25
    ethylbenzene 530.89
    MIBK 855.86
    2-propoxyethanol 1448.97
    tert-butanol 1563.64
    MTBE 2059.43
    2-butoxyethanol 595.52
    propionic acid 444.96
    o-xylene 540.68
    formic acid 27.99
    diethyl ether 2625.24
    m-xylene 736.57
    p-xylene 521.22
    chlorobenzene 956.07
    dimethyl carbonate 193.35
    n-octane 361.2
    formamide 59.3
    cyclopentanone 1471.18
    2-pentanone 1347.15
    anisole 619.88
    cyclopentyl methyl ether 1775.55
    gamma-butyrolactone 1151.06
    1-methoxy-2-propanol 792.22
    pyridine 1614.87
    3-pentanone 930.45
    furfural 653.86
    n-dodecane 176.61
    diethylene glycol 395.36
    diisopropyl ether 853.51
    tert-amyl alcohol 1107.58
    acetylacetone 806.0
    n-hexadecane 200.16
    acetophenone 390.1
    methyl propionate 740.0
    isopentyl acetate 2016.17
    trichloroethylene 1874.42
    n-nonanol 517.54
    cyclohexanol 1191.44
    benzyl alcohol 329.62
    2-ethylhexanol 1669.09
    isooctanol 537.16
    dipropyl ether 2867.31
    1,2-dichlorobenzene 630.82
    ethyl lactate 194.65
    propylene carbonate 754.46
    n-methylformamide 256.23
    2-pentanol 1182.32
    n-pentane 1054.94
    1-propoxy-2-propanol 1507.37
    1-methoxy-2-propyl acetate 1153.81
    2-(2-methoxypropoxy) propanol 466.48
    mesitylene 491.03
    ε-caprolactone 1219.53
    p-cymene 598.55
    epichlorohydrin 1672.3
    1,1,1-trichloroethane 1708.04
    2-aminoethanol 141.17
    morpholine-4-carbaldehyde 612.28
    sulfolane 959.72
    2,2,4-trimethylpentane 291.25
    2-methyltetrahydrofuran 2971.21
    n-hexyl acetate 966.68
    isooctane 345.03
    2-(2-butoxyethoxy)ethanol 700.87
    sec-butyl acetate 558.47
    tert-butyl acetate 890.79
    decalin 351.59
    glycerin 112.88
    diglyme 1199.88
    acrylic acid 218.54
    isopropyl myristate 416.15
    n-butyric acid 1031.19
    acetyl acetate 525.13
    di(2-ethylhexyl) phthalate 250.92
    ethyl propionate 654.88
    nitromethane 478.27
    1,2-diethoxyethane 1897.07
    benzonitrile 653.22
    trioctyl phosphate 229.21
    1-bromopropane 2559.39
    gamma-valerolactone 1170.2
    n-decanol 400.19
    triethyl phosphate 311.7
    4-methyl-2-pentanol 603.07
    propionitrile 1135.84
    vinylene carbonate 531.63
    1,1,2-trichlorotrifluoroethane 439.91
    DMS 376.19
    cumene 317.72
    2-octanol 467.11
    2-hexanone 1000.41
    octyl acetate 459.09
    limonene 1111.15
    1,2-dimethoxyethane 1263.32
    ethyl orthosilicate 361.24
    tributyl phosphate 282.78
    diacetone alcohol 645.18
    N,N-dimethylaniline 352.73
    acrylonitrile 733.98
    aniline 737.94
    1,3-propanediol 346.14
    bromobenzene 1203.07
    dibromomethane 2328.83
    1,1,2,2-tetrachloroethane 1373.65
    2-methyl-cyclohexyl acetate 660.96
    tetrabutyl urea 342.52
    diisobutyl methanol 799.29
    2-phenylethanol 658.58
    styrene 635.7
    dioctyl adipate 409.6
    dimethyl sulfate 198.04
    ethyl butyrate 1568.58
    methyl lactate 177.01
    butyl lactate 363.51
    diethyl carbonate 686.8
    propanediol butyl ether 377.64
    triethyl orthoformate 798.56
    p-tert-butyltoluene 553.47
    methyl 4-tert-butylbenzoate 393.62
    morpholine 2215.96
    tert-butylamine 1432.88
    n-dodecanol 329.02
    dimethoxymethane 821.26
    ethylene carbonate 578.9
    cyrene 258.73
    2-ethoxyethyl acetate 731.73
    2-ethylhexyl acetate 1709.01
    1,2,4-trichlorobenzene 603.21
    4-methylpyridine 1512.93
    dibutyl ether 1494.32
    2,6-dimethyl-4-heptanol 799.29
    DEF 916.95
    dimethyl isosorbide 796.75
    tetrachloroethylene 883.08
    eugenol 309.2
    triacetin 457.99
    span 80 479.11
    1,4-butanediol 119.98
    1,1-dichloroethane 2083.72
    2-methyl-1-pentanol 665.24
    methyl formate 201.9
    2-methyl-1-butanol 1022.21
    n-decane 317.03
    butyronitrile 1705.84
    3,7-dimethyl-1-octanol 682.72
    1-chlorooctane 694.94
    1-chlorotetradecane 268.27
    n-nonane 391.7
    undecane 223.0
    tert-butylcyclohexane 333.83
    cyclooctane 602.62
    cyclopentanol 1002.04
    tetrahydropyran 3787.48
    tert-amyl methyl ether 1128.46
    2,5,8-trioxanonane 728.08
    1-hexene 1906.07
    2-isopropoxyethanol 420.46
    2,2,2-trifluoroethanol 64.76
    methyl butyrate 899.74

    Scent© AI

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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