(6E,10Z)-5,8,9,12-Tetrahydro-4-methoxy-7,11-dimethyl-1-benzocyclodecenol

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  • Identifiers

    CAS number
    117568-32-8

    Molecular formula
    C17H22O2

    SMILES
    C/C/1=C\CC2=C(C=CC(=C2C/C(=C\CC1)/C)O)OC

    Safety labels

  • Odor profile

    Fragrance
    Spicy 68.65%
    Woody 52.43%
    Phenolic 51.44%
    Sweet 48.48%
    Smoky 33.16%
    Leathery 30.35%
    Dry 29.94%
    Clove 29.61%
    Balsamic 28.5%
    Warm 28.23%

     

    Flavor
    Spicy 45.34%
    Woody 44.65%
    Spice 38.72%
    Sweet 33.87%
    Bitter 31.08%
    Phenolic 30.26%
    Floral 30.12%
    Herbal 29.06%
    Powdery 27.24%
    Smoky 26.5%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    3.8

    pKa est.
    9.2 (weak base)

    Molecular weight
    258.35 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    424°C

    Flash point

    • 177.8 ˚C est.

  • Synonyms

    • (6E,10Z)-5,8,9,12-Tetrahydro-4-methoxy-7,11-dimethyl-1-benzocyclodecenol
    • 117568-32-8
    • RefChem:69690
    • DTXSID901148713
    • (6E,10Z)-4-Methoxy-7,11-dimethyl-5,8,9,12-tetrahydrobenzo[10]annulen-1-ol
    • 117568-32-8

  • Applications

    (6E,10Z)-5,8,9,12-Tetrahydro-4-methoxy-7,11-dimethyl-1-benzocyclodecenol (CAS 117568-32-8) is principally considered a fragrance ingredient and odorant, with potential use in perfumery and fragrance formulations; it may be employed in cosmetics and personal care products as a scent component; it can be used in household cleaning products to impart aroma; it may also serve as an intermediate in fragrance chemistry for synthesis of related aroma compounds, with industrial manufacturing applications as a perfumery additive possible under local regulations.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 189.85
    methanol 137.1
    isopropanol 113.58
    water 0.07
    ethyl acetate 407.11
    n-propanol 187.52
    acetone 147.5
    n-butanol 192.56
    acetonitrile 103.23
    DMF 180.97
    toluene 309.29
    isobutanol 114.15
    1,4-dioxane 575.84
    methyl acetate 233.88
    THF 409.73
    2-butanone 259.46
    n-pentanol 95.5
    sec-butanol 102.73
    n-hexane 8.12
    ethylene glycol 20.57
    NMP 117.23
    cyclohexane 34.68
    DMSO 143.97
    n-butyl acetate 205.13
    n-octanol 41.05
    chloroform 790.96
    n-propyl acetate 168.19
    acetic acid 100.43
    dichloromethane 688.16
    cyclohexanone 288.45
    propylene glycol 41.44
    isopropyl acetate 206.97
    DMAc 290.59
    2-ethoxyethanol 183.33
    isopentanol 148.43
    n-heptane 7.33
    ethyl formate 110.57
    1,2-dichloroethane 466.64
    n-hexanol 130.52
    2-methoxyethanol 271.0
    isobutyl acetate 131.34
    tetrachloromethane 71.65
    n-pentyl acetate 113.56
    transcutol 893.59
    n-heptanol 59.05
    ethylbenzene 110.16
    MIBK 130.61
    2-propoxyethanol 244.15
    tert-butanol 147.17
    MTBE 217.58
    2-butoxyethanol 141.28
    propionic acid 89.29
    o-xylene 118.61
    formic acid 26.98
    diethyl ether 420.38
    m-xylene 129.35
    p-xylene 114.8
    chlorobenzene 215.53
    dimethyl carbonate 100.57
    n-octane 3.89
    formamide 58.53
    cyclopentanone 229.9
    2-pentanone 224.03
    anisole 208.18
    cyclopentyl methyl ether 213.76
    gamma-butyrolactone 213.35
    1-methoxy-2-propanol 194.04
    pyridine 459.31
    3-pentanone 212.05
    furfural 239.18
    n-dodecane 3.49
    diethylene glycol 150.16
    diisopropyl ether 73.71
    tert-amyl alcohol 110.55
    acetylacetone 229.75
    n-hexadecane 4.29
    acetophenone 162.29
    methyl propionate 246.73
    isopentyl acetate 202.51
    trichloroethylene 775.14
    n-nonanol 44.37
    cyclohexanol 122.48
    benzyl alcohol 141.22
    2-ethylhexanol 76.53
    isooctanol 53.68
    dipropyl ether 112.46
    1,2-dichlorobenzene 181.03
    ethyl lactate 64.72
    propylene carbonate 139.13
    n-methylformamide 78.3
    2-pentanol 97.67
    n-pentane 10.37
    1-propoxy-2-propanol 145.7
    1-methoxy-2-propyl acetate 226.81
    2-(2-methoxypropoxy) propanol 142.0
    mesitylene 71.71
    ε-caprolactone 242.43
    p-cymene 55.25
    epichlorohydrin 414.85
    1,1,1-trichloroethane 311.97
    2-aminoethanol 58.58
    morpholine-4-carbaldehyde 265.18
    sulfolane 184.36
    2,2,4-trimethylpentane 9.27
    2-methyltetrahydrofuran 275.66
    n-hexyl acetate 138.02
    isooctane 7.44
    2-(2-butoxyethoxy)ethanol 215.57
    sec-butyl acetate 137.24
    tert-butyl acetate 187.9
    decalin 18.03
    glycerin 63.04
    diglyme 430.35
    acrylic acid 70.63
    isopropyl myristate 60.63
    n-butyric acid 178.81
    acetyl acetate 201.46
    di(2-ethylhexyl) phthalate 65.22
    ethyl propionate 150.65
    nitromethane 162.98
    1,2-diethoxyethane 296.57
    benzonitrile 147.45
    trioctyl phosphate 42.69
    1-bromopropane 256.74
    gamma-valerolactone 325.15
    n-decanol 32.75
    triethyl phosphate 73.53
    4-methyl-2-pentanol 64.68
    propionitrile 143.33
    vinylene carbonate 151.65
    1,1,2-trichlorotrifluoroethane 243.34
    DMS 151.27
    cumene 65.2
    2-octanol 34.8
    2-hexanone 133.85
    octyl acetate 69.85
    limonene 69.53
    1,2-dimethoxyethane 340.22
    ethyl orthosilicate 78.12
    tributyl phosphate 54.16
    diacetone alcohol 154.94
    N,N-dimethylaniline 118.55
    acrylonitrile 150.91
    aniline 215.66
    1,3-propanediol 117.18
    bromobenzene 252.26
    dibromomethane 438.63
    1,1,2,2-tetrachloroethane 573.39
    2-methyl-cyclohexyl acetate 120.14
    tetrabutyl urea 63.31
    diisobutyl methanol 48.99
    2-phenylethanol 154.8
    styrene 145.66
    dioctyl adipate 90.22
    dimethyl sulfate 110.49
    ethyl butyrate 141.52
    methyl lactate 73.67
    butyl lactate 84.09
    diethyl carbonate 108.78
    propanediol butyl ether 100.42
    triethyl orthoformate 113.16
    p-tert-butyltoluene 55.53
    methyl 4-tert-butylbenzoate 126.01
    morpholine 605.41
    tert-butylamine 85.1
    n-dodecanol 25.61
    dimethoxymethane 282.46
    ethylene carbonate 133.62
    cyrene 122.13
    2-ethoxyethyl acetate 203.82
    2-ethylhexyl acetate 163.09
    1,2,4-trichlorobenzene 227.45
    4-methylpyridine 368.13
    dibutyl ether 77.98
    2,6-dimethyl-4-heptanol 48.99
    DEF 226.23
    dimethyl isosorbide 232.79
    tetrachloroethylene 345.45
    eugenol 126.76
    triacetin 150.11
    span 80 111.42
    1,4-butanediol 36.18
    1,1-dichloroethane 332.57
    2-methyl-1-pentanol 106.55
    methyl formate 55.42
    2-methyl-1-butanol 140.24
    n-decane 6.35
    butyronitrile 140.79
    3,7-dimethyl-1-octanol 54.81
    1-chlorooctane 35.67
    1-chlorotetradecane 15.48
    n-nonane 5.34
    undecane 4.43
    tert-butylcyclohexane 16.1
    cyclooctane 11.5
    cyclopentanol 71.84
    tetrahydropyran 503.92
    tert-amyl methyl ether 137.06
    2,5,8-trioxanonane 279.19
    1-hexene 51.02
    2-isopropoxyethanol 133.98
    2,2,2-trifluoroethanol 30.47
    methyl butyrate 170.18

    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