6-(2,2,3-Trimethylcyclopent-3-en-1-yl)hex-5-en-3-ol

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  • Identifiers

    CAS number
    68480-05-7

    Molecular formula
    C14H24O

    SMILES
    CCC(CC=CC1CC=C(C1(C)C)C)O

    Safety labels

  • Odor profile

    Fragrance
    Woody 77.39%
    Sandalwood 57.08%
    Amber 37.08%
    Balsamic 33.76%
    Sweet 33.54%
    Dry 33.37%
    Powdery 32.54%
    Oily 31.07%
    Waxy 30.58%
    Violet 30.13%

     

    Flavor
    Woody 70.47%
    Floral 56.96%
    Herbal 51.23%
    Sweet 45.79%
    Citrus 40.81%
    Tropical 38.65%
    Wood 37.03%
    Fresh 34.93%
    Herb 33.9%
    Green 32.58%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    3.5

    pKa est.
    9.8 (weak base)

    Molecular weight
    208.34 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very slow

    Boiling point est.
    264°C

    Flash point

    • 119.4 ˚C est.

  • Synonyms

    • 68480-05-7
    • 6-(2,2,3-Trimethylcyclopent-3-en-1-yl)hex-5-en-3-ol
    • DTXSID0052411
    • RefChem:306455
    • DTXCID2030984
    • 270-881-6
    • 6-(2,2,3-Trimethyl-3-cyclopenten-1-yl)-5-hexen-3-ol
    • 5-Hexen-3-ol, 6-(2,2,3-trimethyl-3-cyclopenten-1-yl)-
    • SCHEMBL5060630
    • ZCPKYSNRVOTPBB-UHFFFAOYSA-N
    • 68480-05-7

  • Applications

    6-(2,2,3-Trimethylcyclopent-3-en-1-yl)hex-5-en-3-ol (CAS 68480-05-7) is a fragrance-related compound that may be used as an odorant or fragrance fixative in perfumery and personal care products; it is also evaluated as a chiral intermediate in organic synthesis for aroma-related compounds; it may serve as a fragrance additive in household cleaning products; in coatings and inks, it can be used to impart or retain scent; and it can function as a building block in polymer/plastics contexts for fragrance-modified materials or aroma-release applications.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1711.14
    methanol 1046.57
    isopropanol 1798.59
    water 1.17
    ethyl acetate 2705.01
    n-propanol 1581.94
    acetone 1806.95
    n-butanol 1588.75
    acetonitrile 1125.13
    DMF 1332.27
    toluene 1141.61
    isobutanol 1141.08
    1,4-dioxane 3461.46
    methyl acetate 1758.36
    THF 3228.87
    2-butanone 1834.29
    n-pentanol 733.32
    sec-butanol 1331.39
    n-hexane 383.9
    ethylene glycol 146.68
    NMP 529.66
    cyclohexane 515.81
    DMSO 869.84
    n-butyl acetate 1327.9
    n-octanol 374.54
    chloroform 2790.08
    n-propyl acetate 1023.44
    acetic acid 568.23
    dichloromethane 2006.39
    cyclohexanone 1371.69
    propylene glycol 380.02
    isopropyl acetate 1882.36
    DMAc 1212.29
    2-ethoxyethanol 1128.38
    isopentanol 1385.32
    n-heptane 160.57
    ethyl formate 669.6
    1,2-dichloroethane 1498.16
    n-hexanol 1100.66
    2-methoxyethanol 1806.01
    isobutyl acetate 686.75
    tetrachloromethane 696.32
    n-pentyl acetate 584.54
    transcutol 4680.04
    n-heptanol 406.64
    ethylbenzene 524.57
    MIBK 1078.69
    2-propoxyethanol 1564.26
    tert-butanol 2445.28
    MTBE 4119.67
    2-butoxyethanol 765.6
    propionic acid 730.1
    o-xylene 600.73
    formic acid 156.5
    diethyl ether 3565.74
    m-xylene 757.06
    p-xylene 627.89
    chlorobenzene 836.49
    dimethyl carbonate 534.82
    n-octane 62.39
    formamide 380.63
    cyclopentanone 1256.79
    2-pentanone 1632.39
    anisole 1139.36
    cyclopentyl methyl ether 1557.11
    gamma-butyrolactone 1151.77
    1-methoxy-2-propanol 1747.09
    pyridine 1643.15
    3-pentanone 1261.57
    furfural 962.19
    n-dodecane 36.69
    diethylene glycol 808.23
    diisopropyl ether 1169.69
    tert-amyl alcohol 1750.75
    acetylacetone 1528.19
    n-hexadecane 43.81
    acetophenone 654.68
    methyl propionate 1445.92
    isopentyl acetate 1212.83
    trichloroethylene 2216.99
    n-nonanol 361.88
    cyclohexanol 914.81
    benzyl alcohol 547.54
    2-ethylhexanol 598.81
    isooctanol 378.56
    dipropyl ether 1114.72
    1,2-dichlorobenzene 742.51
    ethyl lactate 333.27
    propylene carbonate 741.98
    n-methylformamide 686.06
    2-pentanol 1246.8
    n-pentane 390.17
    1-propoxy-2-propanol 1225.22
    1-methoxy-2-propyl acetate 1495.99
    2-(2-methoxypropoxy) propanol 816.74
    mesitylene 505.87
    ε-caprolactone 1207.29
    p-cymene 291.0
    epichlorohydrin 1809.58
    1,1,1-trichloroethane 1848.73
    2-aminoethanol 506.68
    morpholine-4-carbaldehyde 1248.31
    sulfolane 887.55
    2,2,4-trimethylpentane 185.9
    2-methyltetrahydrofuran 2206.98
    n-hexyl acetate 811.65
    isooctane 187.42
    2-(2-butoxyethoxy)ethanol 1190.14
    sec-butyl acetate 949.66
    tert-butyl acetate 1859.74
    decalin 206.98
    glycerin 380.63
    diglyme 2125.51
    acrylic acid 413.25
    isopropyl myristate 337.28
    n-butyric acid 1271.06
    acetyl acetate 1098.04
    di(2-ethylhexyl) phthalate 250.97
    ethyl propionate 1020.43
    nitromethane 990.34
    1,2-diethoxyethane 2125.84
    benzonitrile 618.88
    trioctyl phosphate 175.13
    1-bromopropane 1387.3
    gamma-valerolactone 1673.96
    n-decanol 259.42
    triethyl phosphate 346.84
    4-methyl-2-pentanol 769.34
    propionitrile 1224.02
    vinylene carbonate 692.75
    1,1,2-trichlorotrifluoroethane 962.32
    DMS 698.07
    cumene 354.82
    2-octanol 291.77
    2-hexanone 909.92
    octyl acetate 384.01
    limonene 415.96
    1,2-dimethoxyethane 2007.43
    ethyl orthosilicate 393.87
    tributyl phosphate 242.27
    diacetone alcohol 1220.71
    N,N-dimethylaniline 619.96
    acrylonitrile 984.08
    aniline 1094.37
    1,3-propanediol 902.34
    bromobenzene 966.24
    dibromomethane 1503.11
    1,1,2,2-tetrachloroethane 2049.84
    2-methyl-cyclohexyl acetate 602.14
    tetrabutyl urea 259.13
    diisobutyl methanol 421.06
    2-phenylethanol 691.94
    styrene 627.36
    dioctyl adipate 405.05
    dimethyl sulfate 540.77
    ethyl butyrate 904.46
    methyl lactate 472.35
    butyl lactate 429.85
    diethyl carbonate 605.93
    propanediol butyl ether 637.69
    triethyl orthoformate 666.05
    p-tert-butyltoluene 340.92
    methyl 4-tert-butylbenzoate 615.81
    morpholine 3597.79
    tert-butylamine 1954.36
    n-dodecanol 191.46
    dimethoxymethane 1634.83
    ethylene carbonate 706.08
    cyrene 404.99
    2-ethoxyethyl acetate 955.65
    2-ethylhexyl acetate 896.42
    1,2,4-trichlorobenzene 819.73
    4-methylpyridine 1574.58
    dibutyl ether 754.68
    2,6-dimethyl-4-heptanol 421.06
    DEF 1291.7
    dimethyl isosorbide 1080.07
    tetrachloroethylene 1313.09
    eugenol 526.3
    triacetin 756.45
    span 80 594.51
    1,4-butanediol 260.07
    1,1-dichloroethane 1931.22
    2-methyl-1-pentanol 726.91
    methyl formate 397.59
    2-methyl-1-butanol 1152.39
    n-decane 71.85
    butyronitrile 1259.56
    3,7-dimethyl-1-octanol 514.63
    1-chlorooctane 271.99
    1-chlorotetradecane 106.32
    n-nonane 72.87
    undecane 48.87
    tert-butylcyclohexane 211.28
    cyclooctane 189.09
    cyclopentanol 724.59
    tetrahydropyran 3258.34
    tert-amyl methyl ether 1863.09
    2,5,8-trioxanonane 1297.01
    1-hexene 868.68
    2-isopropoxyethanol 892.02
    2,2,2-trifluoroethanol 234.19
    methyl butyrate 1055.5

    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