(Z)-1-(3-Hexenyl)cyclohexan-1-ol

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  • Identifiers

    CAS number
    93963-11-2

    Molecular formula
    C12H22O

    SMILES
    CC/C=C\CCC1(CCCCC1)O

    Safety labels

  • Odor profile

    Fragrance
    Floral 81.67%
    Fruity 63.64%
    Green 51.64%
    Jasmin 51.06%
    Herbal 45.63%
    Waxy 44.43%
    Fresh 42.88%
    Oily 40.31%
    Tropical 35.93%
    Rose 34.85%

     

    Flavor
    Fresh 37.83%
    Herbal 31.45%
    Green 31.13%
    Woody 29.13%
    Fatty 26.74%
    Floral 26.57%
    Waxy 25.42%
    Spicy 24.53%
    Herb 24.44%
    Spice 23.31%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    3.3

    pKa est.
    9.19 (weak base)

    Molecular weight
    182.3 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    251°C

    Flash point

    • 120.48 ˚C est.

  • Synonyms

    • (Z)-1-(3-Hexenyl)cyclohexan-1-ol
    • 93963-11-2
    • EINECS 300-751-7
    • 1-[(3Z)-HEX-3-EN-1-YL]CYCLOHEXAN-1-OL
    • SPUDXAQAHJIHFG-ARJAWSKDSA-N
    • DTXSID201297682
    • Cyclohexanol, 1-(3-hexenyl)-, (Z)-
    • NS00064089
    • 93963-11-2

  • Applications

    For (Z)-1-(3-Hexenyl)cyclohexan-1-ol (CAS 93963-11-2), the compound is often used as an odorant and fragrance ingredient in perfumery and cosmetics; commonly evaluated as an intermediate in fragrance synthesis for downstream aroma compounds; may be used as a fragrance additive in household products such as air fresheners and cleaners; serves as an industrial manufacturing intermediate for the synthesis of aroma-related specialty chemicals; can be used in coatings or inks as a fragrance additive, subject to formulation constraints.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3092.07
    methanol 2078.61
    isopropanol 3023.5
    water 0.08
    ethyl acetate 3822.14
    n-propanol 2706.11
    acetone 3590.93
    n-butanol 2954.24
    acetonitrile 1787.44
    DMF 1684.6
    toluene 1490.11
    isobutanol 2030.14
    1,4-dioxane 4560.07
    methyl acetate 2101.61
    THF 5986.37
    2-butanone 3010.39
    n-pentanol 1763.72
    sec-butanol 2534.2
    n-hexane 2138.54
    ethylene glycol 120.76
    NMP 879.99
    cyclohexane 2028.93
    DMSO 1872.15
    n-butyl acetate 3349.58
    n-octanol 891.35
    chloroform 3745.89
    n-propyl acetate 1882.61
    acetic acid 826.9
    dichloromethane 3000.12
    cyclohexanone 2923.43
    propylene glycol 318.48
    isopropyl acetate 2558.93
    DMAc 1210.28
    2-ethoxyethanol 1423.87
    isopentanol 2705.03
    n-heptane 996.74
    ethyl formate 1029.27
    1,2-dichloroethane 2455.9
    n-hexanol 2881.98
    2-methoxyethanol 2193.62
    isobutyl acetate 1239.51
    tetrachloromethane 818.7
    n-pentyl acetate 1472.61
    transcutol 6540.16
    n-heptanol 980.87
    ethylbenzene 652.67
    MIBK 1847.89
    2-propoxyethanol 2704.63
    tert-butanol 4003.3
    MTBE 6310.64
    2-butoxyethanol 1318.3
    propionic acid 976.84
    o-xylene 660.04
    formic acid 134.52
    diethyl ether 7216.48
    m-xylene 870.6
    p-xylene 698.88
    chlorobenzene 1172.42
    dimethyl carbonate 424.77
    n-octane 281.78
    formamide 236.16
    cyclopentanone 2352.57
    2-pentanone 3263.81
    anisole 989.81
    cyclopentyl methyl ether 3119.83
    gamma-butyrolactone 1951.19
    1-methoxy-2-propanol 2117.85
    pyridine 2523.33
    3-pentanone 2074.57
    furfural 1188.96
    n-dodecane 143.18
    diethylene glycol 884.66
    diisopropyl ether 2176.95
    tert-amyl alcohol 2823.05
    acetylacetone 1810.06
    n-hexadecane 166.73
    acetophenone 691.71
    methyl propionate 1801.1
    isopentyl acetate 2656.04
    trichloroethylene 2932.91
    n-nonanol 782.5
    cyclohexanol 2105.1
    benzyl alcohol 624.29
    2-ethylhexanol 1762.07
    isooctanol 803.44
    dipropyl ether 3782.16
    1,2-dichlorobenzene 859.8
    ethyl lactate 413.81
    propylene carbonate 1194.27
    n-methylformamide 725.96
    2-pentanol 2494.03
    n-pentane 1542.33
    1-propoxy-2-propanol 2322.27
    1-methoxy-2-propyl acetate 1928.45
    2-(2-methoxypropoxy) propanol 977.49
    mesitylene 597.79
    ε-caprolactone 2260.0
    p-cymene 459.49
    epichlorohydrin 2592.61
    1,1,1-trichloroethane 2405.06
    2-aminoethanol 472.44
    morpholine-4-carbaldehyde 1475.94
    sulfolane 1557.38
    2,2,4-trimethylpentane 406.32
    2-methyltetrahydrofuran 4507.25
    n-hexyl acetate 1786.32
    isooctane 439.24
    2-(2-butoxyethoxy)ethanol 1696.98
    sec-butyl acetate 1413.45
    tert-butyl acetate 2362.25
    decalin 520.9
    glycerin 368.35
    diglyme 2641.03
    acrylic acid 485.43
    isopropyl myristate 650.89
    n-butyric acid 2452.54
    acetyl acetate 1227.16
    di(2-ethylhexyl) phthalate 389.92
    ethyl propionate 1567.49
    nitromethane 1195.24
    1,2-diethoxyethane 4080.72
    benzonitrile 923.43
    trioctyl phosphate 349.0
    1-bromopropane 3163.36
    gamma-valerolactone 2567.46
    n-decanol 571.69
    triethyl phosphate 469.0
    4-methyl-2-pentanol 1431.82
    propionitrile 2202.26
    vinylene carbonate 871.1
    1,1,2-trichlorotrifluoroethane 1157.69
    DMS 786.64
    cumene 430.01
    2-octanol 693.37
    2-hexanone 1966.38
    octyl acetate 703.94
    limonene 936.29
    1,2-dimethoxyethane 3084.1
    ethyl orthosilicate 566.19
    tributyl phosphate 491.6
    diacetone alcohol 1509.91
    N,N-dimethylaniline 583.33
    acrylonitrile 1420.25
    aniline 1322.31
    1,3-propanediol 1079.9
    bromobenzene 1338.06
    dibromomethane 2699.36
    1,1,2,2-tetrachloroethane 2614.26
    2-methyl-cyclohexyl acetate 969.7
    tetrabutyl urea 513.12
    diisobutyl methanol 936.48
    2-phenylethanol 941.72
    styrene 852.17
    dioctyl adipate 689.43
    dimethyl sulfate 438.16
    ethyl butyrate 1965.56
    methyl lactate 451.19
    butyl lactate 772.5
    diethyl carbonate 919.06
    propanediol butyl ether 970.99
    triethyl orthoformate 1176.12
    p-tert-butyltoluene 501.0
    methyl 4-tert-butylbenzoate 673.69
    morpholine 5060.95
    tert-butylamine 3629.21
    n-dodecanol 443.74
    dimethoxymethane 2228.71
    ethylene carbonate 996.64
    cyrene 484.82
    2-ethoxyethyl acetate 1482.65
    2-ethylhexyl acetate 2065.58
    1,2,4-trichlorobenzene 879.82
    4-methylpyridine 2480.98
    dibutyl ether 2540.11
    2,6-dimethyl-4-heptanol 936.48
    DEF 2316.07
    dimethyl isosorbide 1257.95
    tetrachloroethylene 1754.7
    eugenol 552.21
    triacetin 930.76
    span 80 981.78
    1,4-butanediol 298.76
    1,1-dichloroethane 3064.45
    2-methyl-1-pentanol 1500.07
    methyl formate 446.59
    2-methyl-1-butanol 2152.01
    n-decane 296.5
    butyronitrile 2901.03
    3,7-dimethyl-1-octanol 1041.44
    1-chlorooctane 823.78
    1-chlorotetradecane 297.52
    n-nonane 344.9
    undecane 194.58
    tert-butylcyclohexane 497.32
    cyclooctane 624.51
    cyclopentanol 1535.74
    tetrahydropyran 6862.2
    tert-amyl methyl ether 3130.05
    2,5,8-trioxanonane 1458.21
    1-hexene 3665.15
    2-isopropoxyethanol 1216.33
    2,2,2-trifluoroethanol 167.95
    methyl butyrate 1927.63

    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