2,6,6-Trimethylcyclohexene-1-methanol

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  • Identifiers

    CAS number
    472-20-8

    Molecular formula
    C10H18O

    SMILES
    CC1=C(C(CCC1)(C)C)CO

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Woody 72.46%
    Floral 67.82%
    Sweet 66.53%
    Fruity 59.51%
    Herbal 44.26%
    Rose 43.06%
    Camphoreous 38.58%
    Earthy 36.93%
    Spicy 36.72%
    Powdery 36.11%

    Scent© AI

  • Properties

    XLogP3-AA
    1.9

    Molecular weight
    154.25 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderate

    Boiling point est.
    212°C

    Flash point est.
    97.75 ˚C

  • Synonyms

    • 472-20-8
    • 2,6,6-Trimethylcyclohexene-1-methanol
    • BETA-CYCLOGERANIOL
    • (2,6,6-TRIMETHYLCYCLOHEX-1-EN-1-YL)METHANOL
    • B-Cyclogeraniol
    • (2,6,6-trimethylcyclohexen-1-yl)methanol
    • 1-Cyclohexene-1-methanol, 2,6,6-trimethyl-
    • .beta.-Cyclogeraniol
    • 1-Cyclohexene-1-methanol,2,6,6-trimethyl-
    • EINECS 207-449-3
    • 2,6,6-Trimethyl-1-cyclohexene-1-methanol
    • AI3-37228
    • DTXSID60197061
    • Cyclogeraniol
    • ?-Cyclogeraniol
    • beta -Cyclogeraniol
    • XD3YT58R9H
    • SCHEMBL4666701
    • DTXCID70119552
    • CHEBI:167402
    • MFCD09840290
    • AKOS006329213
    • HY-W024698
    • SB84197
    • AS-65066
    • (2,6,6-trimethylcyclohex-1-enyl)methanol
    • DB-239559
    • CS-0061209
    • NS00031671
    • W17219
    • EN300-6767278
    • 2,6,6-trimethyl-1-cyclohexene-1-methanol, AldrichCPR
    • Z1198234378
    • 207-449-3
    • 6KX

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3225.94
    methanol 3187.35
    isopropanol 2449.09
    water 6.12
    ethyl acetate 1724.3
    n-propanol 2905.4
    acetone 1907.54
    n-butanol 2103.3
    acetonitrile 2921.08
    DMF 1407.6
    toluene 730.97
    isobutanol 1696.81
    1,4-dioxane 4443.23
    methyl acetate 1644.21
    THF 6015.11
    2-butanone 1671.76
    n-pentanol 958.54
    sec-butanol 1558.98
    n-hexane 213.83
    ethylene glycol 320.15
    NMP 1029.84
    cyclohexane 384.63
    DMSO 1263.76
    n-butyl acetate 1219.05
    n-octanol 480.68
    chloroform 2441.96
    n-propyl acetate 764.67
    acetic acid 1212.2
    dichloromethane 2078.02
    cyclohexanone 1954.39
    propylene glycol 365.27
    isopropyl acetate 867.58
    DMAc 429.69
    2-ethoxyethanol 1105.4
    isopentanol 1214.44
    n-heptane 221.06
    ethyl formate 1137.99
    1,2-dichloroethane 1528.68
    n-hexanol 1814.51
    2-methoxyethanol 2156.1
    isobutyl acetate 435.46
    tetrachloromethane 678.91
    n-pentyl acetate 554.46
    transcutol 1813.14
    n-heptanol 581.14
    ethylbenzene 273.53
    MIBK 699.85
    2-propoxyethanol 1923.76
    tert-butanol 2165.22
    MTBE 1880.46
    2-butoxyethanol 767.87
    propionic acid 1199.15
    o-xylene 307.78
    formic acid 509.57
    diethyl ether 2543.7
    m-xylene 448.26
    p-xylene 323.84
    chlorobenzene 778.81
    dimethyl carbonate 309.39
    n-octane 77.57
    formamide 683.61
    cyclopentanone 2380.36
    2-pentanone 1401.49
    anisole 572.61
    cyclopentyl methyl ether 1955.45
    gamma-butyrolactone 2561.94
    1-methoxy-2-propanol 1370.75
    pyridine 1766.69
    3-pentanone 861.9
    furfural 1259.25
    n-dodecane 45.38
    diethylene glycol 921.27
    diisopropyl ether 584.11
    tert-amyl alcohol 1179.46
    acetylacetone 877.08
    n-hexadecane 51.96
    acetophenone 322.52
    methyl propionate 1037.99
    isopentyl acetate 837.43
    trichloroethylene 2007.05
    n-nonanol 379.26
    cyclohexanol 1255.23
    benzyl alcohol 386.63
    2-ethylhexanol 651.84
    isooctanol 399.61
    dipropyl ether 1035.05
    1,2-dichlorobenzene 487.12
    ethyl lactate 215.94
    propylene carbonate 973.26
    n-methylformamide 1467.75
    2-pentanol 1106.8
    n-pentane 314.26
    1-propoxy-2-propanol 1131.62
    1-methoxy-2-propyl acetate 828.93
    2-(2-methoxypropoxy) propanol 362.87
    mesitylene 286.73
    ε-caprolactone 1487.18
    p-cymene 202.76
    epichlorohydrin 2552.12
    1,1,1-trichloroethane 1612.72
    2-aminoethanol 893.6
    morpholine-4-carbaldehyde 1278.91
    sulfolane 1590.65
    2,2,4-trimethylpentane 104.58
    2-methyltetrahydrofuran 3479.32
    n-hexyl acetate 708.17
    isooctane 118.54
    2-(2-butoxyethoxy)ethanol 650.31
    sec-butyl acetate 418.06
    tert-butyl acetate 827.75
    decalin 103.34
    glycerin 409.23
    diglyme 1138.87
    acrylic acid 778.28
    isopropyl myristate 217.81
    n-butyric acid 1514.41
    acetyl acetate 616.77
    di(2-ethylhexyl) phthalate 147.67
    ethyl propionate 558.58
    nitromethane 2098.79
    1,2-diethoxyethane 1046.52
    benzonitrile 652.62
    trioctyl phosphate 146.36
    1-bromopropane 1404.5
    gamma-valerolactone 2536.21
    n-decanol 266.55
    triethyl phosphate 166.91
    4-methyl-2-pentanol 532.56
    propionitrile 2387.32
    vinylene carbonate 847.97
    1,1,2-trichlorotrifluoroethane 792.0
    DMS 354.83
    cumene 167.79
    2-octanol 359.93
    2-hexanone 773.93
    octyl acetate 276.95
    limonene 341.97
    1,2-dimethoxyethane 1745.08
    ethyl orthosilicate 184.7
    tributyl phosphate 166.62
    diacetone alcohol 762.95
    N,N-dimethylaniline 256.36
    acrylonitrile 2002.72
    aniline 852.4
    1,3-propanediol 1283.21
    bromobenzene 736.67
    dibromomethane 1588.45
    1,1,2,2-tetrachloroethane 1321.16
    2-methyl-cyclohexyl acetate 331.9
    tetrabutyl urea 180.96
    diisobutyl methanol 345.34
    2-phenylethanol 572.34
    styrene 330.78
    dioctyl adipate 219.86
    dimethyl sulfate 333.46
    ethyl butyrate 601.77
    methyl lactate 309.29
    butyl lactate 280.13
    diethyl carbonate 308.48
    propanediol butyl ether 418.58
    triethyl orthoformate 378.64
    p-tert-butyltoluene 217.42
    methyl 4-tert-butylbenzoate 320.08
    morpholine 4700.16
    tert-butylamine 1455.23
    n-dodecanol 189.98
    dimethoxymethane 1361.6
    ethylene carbonate 843.91
    cyrene 274.23
    2-ethoxyethyl acetate 631.51
    2-ethylhexyl acetate 603.14
    1,2,4-trichlorobenzene 502.91
    4-methylpyridine 1493.08
    dibutyl ether 547.06
    2,6-dimethyl-4-heptanol 345.34
    DEF 908.68
    dimethyl isosorbide 601.74
    tetrachloroethylene 979.29
    eugenol 296.46
    triacetin 294.05
    span 80 354.57
    1,4-butanediol 347.18
    1,1-dichloroethane 1931.5
    2-methyl-1-pentanol 529.12
    methyl formate 1047.8
    2-methyl-1-butanol 1089.47
    n-decane 89.09
    butyronitrile 2330.2
    3,7-dimethyl-1-octanol 373.55
    1-chlorooctane 330.11
    1-chlorotetradecane 103.06
    n-nonane 93.89
    undecane 60.98
    tert-butylcyclohexane 112.84
    cyclooctane 127.1
    cyclopentanol 1571.09
    tetrahydropyran 4524.39
    tert-amyl methyl ether 870.88
    2,5,8-trioxanonane 586.81
    1-hexene 645.42
    2-isopropoxyethanol 664.75
    2,2,2-trifluoroethanol 378.67
    methyl butyrate 722.71

    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