2-Methyl-5-prop-1-en-2-ylcyclohexene-1-carbaldehyde

  • Identifiers

    Molecular formula
    C11H16O

    SMILES
    CC1=C(CC(CC1)C(=C)C)C=O

  • Odor profile

    Fragrance
    Herbal 75.26%
    Mint 62.95%
    Green 61.35%
    Spicy 58.74%
    Fruity 57.37%
    Citrus 54.36%
    Sweet 49.86%
    Fresh 49.74%
    Woody 44.98%
    Fatty 41.88%

     

    Flavor
    Herbal 64.85%
    Spicy 49.17%
    Spice 47.09%
    Minty 46.17%
    Fresh 45.66%
    Mint 45.34%
    Sweet 44.71%
    Fatty 40.45%
    Fat 38.1%
    Woody 35.0%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    2.5

    pKa est.
    8.35 (weak base)

    Molecular weight
    164.24 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately slow

    Boiling point est.
    242°C

    Flash point

    • 93.99 ˚C est.

  • Applications

    2-Methyl-5-prop-1-en-2-ylcyclohexene-1-carbaldehyde is used as a fragrance ingredient and odorant in the fragrance industry; it commonly serves as an intermediate in the synthesis of aroma compounds for perfumery and flavor applications; it may act as a building block in cosmetics and personal care formulations to enable fragrance delivery; it can function as an odor-active component in household and cleaning products; in industrial manufacturing, it is used as a chemical intermediate for the synthesis of fragrance and aroma molecules.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 709.16
    methanol 251.04
    isopropanol 729.87
    water 0.38
    ethyl acetate 1175.04
    n-propanol 679.04
    acetone 1030.2
    n-butanol 630.5
    acetonitrile 1276.98
    DMF 1005.13
    toluene 514.49
    isobutanol 436.07
    1,4-dioxane 1897.6
    methyl acetate 1041.85
    THF 2001.71
    2-butanone 1038.65
    n-pentanol 260.43
    sec-butanol 483.66
    n-hexane 18.95
    ethylene glycol 52.08
    NMP 579.09
    cyclohexane 70.31
    DMSO 581.72
    n-butyl acetate 813.83
    n-octanol 126.62
    chloroform 2470.24
    n-propyl acetate 485.23
    acetic acid 464.23
    dichloromethane 2630.66
    cyclohexanone 1192.46
    propylene glycol 123.09
    isopropyl acetate 545.04
    DMAc 562.99
    2-ethoxyethanol 342.1
    isopentanol 474.73
    n-heptane 28.37
    ethyl formate 718.12
    1,2-dichloroethane 1359.92
    n-hexanol 449.06
    2-methoxyethanol 768.95
    isobutyl acetate 254.0
    tetrachloromethane 267.83
    n-pentyl acetate 273.98
    transcutol 1559.59
    n-heptanol 141.98
    ethylbenzene 197.69
    MIBK 362.02
    2-propoxyethanol 662.91
    tert-butanol 744.78
    MTBE 548.29
    2-butoxyethanol 291.2
    propionic acid 452.24
    o-xylene 241.61
    formic acid 103.76
    diethyl ether 655.2
    m-xylene 295.8
    p-xylene 281.19
    chlorobenzene 713.4
    dimethyl carbonate 217.4
    n-octane 10.12
    formamide 269.65
    cyclopentanone 1329.26
    2-pentanone 739.32
    anisole 450.95
    cyclopentyl methyl ether 559.78
    gamma-butyrolactone 1435.28
    1-methoxy-2-propanol 624.78
    pyridine 1564.55
    3-pentanone 463.37
    furfural 1103.72
    n-dodecane 8.76
    diethylene glycol 319.57
    diisopropyl ether 148.35
    tert-amyl alcohol 401.44
    acetylacetone 720.65
    n-hexadecane 10.68
    acetophenone 344.09
    methyl propionate 633.1
    isopentyl acetate 585.32
    trichloroethylene 2548.82
    n-nonanol 115.07
    cyclohexanol 448.11
    benzyl alcohol 314.44
    2-ethylhexanol 229.54
    isooctanol 117.78
    dipropyl ether 321.55
    1,2-dichlorobenzene 510.59
    ethyl lactate 155.82
    propylene carbonate 766.74
    n-methylformamide 524.07
    2-pentanol 343.52
    n-pentane 28.54
    1-propoxy-2-propanol 515.22
    1-methoxy-2-propyl acetate 630.16
    2-(2-methoxypropoxy) propanol 294.15
    mesitylene 159.73
    ε-caprolactone 966.46
    p-cymene 142.5
    epichlorohydrin 1882.17
    1,1,1-trichloroethane 1282.26
    2-aminoethanol 179.24
    morpholine-4-carbaldehyde 842.85
    sulfolane 773.65
    2,2,4-trimethylpentane 17.85
    2-methyltetrahydrofuran 1422.46
    n-hexyl acetate 348.18
    isooctane 18.8
    2-(2-butoxyethoxy)ethanol 440.33
    sec-butyl acetate 297.69
    tert-butyl acetate 442.86
    decalin 30.81
    glycerin 128.4
    diglyme 894.54
    acrylic acid 300.6
    isopropyl myristate 130.75
    n-butyric acid 843.69
    acetyl acetate 478.11
    di(2-ethylhexyl) phthalate 132.08
    ethyl propionate 405.83
    nitromethane 1120.11
    1,2-diethoxyethane 636.76
    benzonitrile 635.64
    trioctyl phosphate 83.54
    1-bromopropane 692.69
    gamma-valerolactone 1511.03
    n-decanol 87.24
    triethyl phosphate 145.93
    4-methyl-2-pentanol 186.83
    propionitrile 864.02
    vinylene carbonate 717.19
    1,1,2-trichlorotrifluoroethane 571.83
    DMS 307.21
    cumene 121.66
    2-octanol 89.86
    2-hexanone 417.08
    octyl acetate 162.73
    limonene 201.86
    1,2-dimethoxyethane 808.53
    ethyl orthosilicate 136.59
    tributyl phosphate 116.08
    diacetone alcohol 432.65
    N,N-dimethylaniline 222.34
    acrylonitrile 955.81
    aniline 574.08
    1,3-propanediol 383.29
    bromobenzene 732.73
    dibromomethane 1507.25
    1,1,2,2-tetrachloroethane 1534.72
    2-methyl-cyclohexyl acetate 273.34
    tetrabutyl urea 141.48
    diisobutyl methanol 146.24
    2-phenylethanol 374.45
    styrene 273.21
    dioctyl adipate 191.64
    dimethyl sulfate 229.2
    ethyl butyrate 475.48
    methyl lactate 203.39
    butyl lactate 188.14
    diethyl carbonate 301.21
    propanediol butyl ether 233.51
    triethyl orthoformate 261.56
    p-tert-butyltoluene 138.22
    methyl 4-tert-butylbenzoate 274.7
    morpholine 2093.32
    tert-butylamine 418.57
    n-dodecanol 66.59
    dimethoxymethane 639.71
    ethylene carbonate 596.72
    cyrene 233.91
    2-ethoxyethyl acetate 438.15
    2-ethylhexyl acetate 421.79
    1,2,4-trichlorobenzene 581.8
    4-methylpyridine 1281.86
    dibutyl ether 225.8
    2,6-dimethyl-4-heptanol 146.24
    DEF 620.71
    dimethyl isosorbide 592.54
    tetrachloroethylene 835.14
    eugenol 252.23
    triacetin 299.07
    span 80 237.09
    1,4-butanediol 88.58
    1,1-dichloroethane 1567.26
    2-methyl-1-pentanol 222.58
    methyl formate 408.78
    2-methyl-1-butanol 376.35
    n-decane 14.95
    butyronitrile 955.35
    3,7-dimethyl-1-octanol 161.11
    1-chlorooctane 100.05
    1-chlorotetradecane 37.12
    n-nonane 13.06
    undecane 11.1
    tert-butylcyclohexane 28.09
    cyclooctane 17.74
    cyclopentanol 505.29
    tetrahydropyran 1620.5
    tert-amyl methyl ether 279.44
    2,5,8-trioxanonane 537.49
    1-hexene 131.96
    2-isopropoxyethanol 245.69
    2,2,2-trifluoroethanol 145.29
    methyl butyrate 560.78

    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