(+)-Sabinone

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  • Identifiers

    CAS number
    67690-48-6

    Molecular formula
    C10H14O

    SMILES
    CC(C)[C@@]12C[C@@H]1C(=C)C(=O)C2

    Safety labels

  • Odor profile

    Fragrance
    Woody 67.81%
    Mint 51.61%
    Herbal 49.32%
    Spicy 46.72%
    Camphoreous 46.3%
    Cooling 35.92%
    Cedar 30.14%
    Fresh 29.83%
    Green 28.25%
    Pine 27.88%

     

    Flavor
    Bitter 74.86%
    Cedarleaf 22.35%
    Herbal 21.62%
    Minty 20.62%
    Lovage 20.34%
    Basil 20.09%
    Ripe apricot 18.66%
    Heather 18.62%
    Leaves 18.59%
    Broom 18.52%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    2.2

    pKa est.
    8.19 (weak base)

    Molecular weight
    150.22 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately fast

    Boiling point est.
    218°C

    Flash point

    • 64.4 ˚C est.

  • Synonyms

    • (+)-Sabinone
    • (1S,5S)-4-methylidene-1-(propan-2-yl)bicyclo[3.1.0]hexan-3-one
    • CHEBI:15403
    • (1S,5S)-4-methylidene-1-propan-2-ylbicyclo[3.1.0]hexan-3-one
    • 67690-48-6
    • (1S,5S)-4-methylidene-1-(propan-2-yl)bicyclo(3.1.0)hexan-3-one
    • (1S,5S)-4-methylidene-1-propan-2-ylbicyclo(3.1.0)hexan-3-one
    • RefChem:67504
    • dehydrothujone
    • (1S,5S)-sabinone
    • C01868
    • SCHEMBL12189735
    • LMPR0102120049
    • Q27089419
    • 67690-48-6

  • Applications

    (+)-Sabinone (CAS 67690-48-6) is used as an odorant in fragrance and flavor applications, where it may contribute to aroma profiles in perfumery. It can also serve as an intermediate in fragrance synthesis and related aroma chemistry. It is sometimes incorporated in cosmetics/personal care formulations as a fragrance ingredient and in household products for scent. It may be evaluated for use in coatings and inks as an odorant additive, all subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1111.77
    methanol 1047.4
    isopropanol 1184.38
    water 9.57
    ethyl acetate 1085.99
    n-propanol 993.13
    acetone 1554.59
    n-butanol 813.15
    acetonitrile 1053.37
    DMF 1597.36
    toluene 425.42
    isobutanol 767.7
    1,4-dioxane 1795.05
    methyl acetate 1356.11
    THF 2039.24
    2-butanone 1354.84
    n-pentanol 427.7
    sec-butanol 803.36
    n-hexane 43.61
    ethylene glycol 358.41
    NMP 448.46
    cyclohexane 62.41
    DMSO 827.97
    n-butyl acetate 534.44
    n-octanol 243.35
    chloroform 1583.82
    n-propyl acetate 530.32
    acetic acid 482.15
    dichloromethane 1224.11
    cyclohexanone 807.36
    propylene glycol 448.97
    isopropyl acetate 728.24
    DMAc 1032.74
    2-ethoxyethanol 890.1
    isopentanol 660.4
    n-heptane 33.13
    ethyl formate 624.39
    1,2-dichloroethane 908.82
    n-hexanol 553.26
    2-methoxyethanol 1612.89
    isobutyl acetate 383.94
    tetrachloromethane 275.66
    n-pentyl acetate 337.63
    transcutol 1431.45
    n-heptanol 269.88
    ethylbenzene 261.51
    MIBK 595.68
    2-propoxyethanol 1133.43
    tert-butanol 1081.55
    MTBE 1026.94
    2-butoxyethanol 563.56
    propionic acid 550.2
    o-xylene 248.66
    formic acid 253.24
    diethyl ether 890.92
    m-xylene 309.9
    p-xylene 389.77
    chlorobenzene 507.89
    dimethyl carbonate 440.35
    n-octane 23.54
    formamide 483.21
    cyclopentanone 1119.25
    2-pentanone 943.62
    anisole 664.53
    cyclopentyl methyl ether 618.06
    gamma-butyrolactone 1090.66
    1-methoxy-2-propanol 1285.91
    pyridine 1057.0
    3-pentanone 669.3
    furfural 883.57
    n-dodecane 21.05
    diethylene glycol 926.42
    diisopropyl ether 280.48
    tert-amyl alcohol 704.47
    acetylacetone 1001.6
    n-hexadecane 24.25
    acetophenone 450.18
    methyl propionate 831.87
    isopentyl acetate 537.4
    trichloroethylene 1429.14
    n-nonanol 224.31
    cyclohexanol 415.59
    benzyl alcohol 439.63
    2-ethylhexanol 251.65
    isooctanol 223.47
    dipropyl ether 297.31
    1,2-dichlorobenzene 407.07
    ethyl lactate 289.81
    propylene carbonate 542.82
    n-methylformamide 896.24
    2-pentanol 562.47
    n-pentane 56.9
    1-propoxy-2-propanol 728.1
    1-methoxy-2-propyl acetate 697.75
    2-(2-methoxypropoxy) propanol 424.13
    mesitylene 189.37
    ε-caprolactone 650.6
    p-cymene 132.04
    epichlorohydrin 1607.12
    1,1,1-trichloroethane 875.46
    2-aminoethanol 612.16
    morpholine-4-carbaldehyde 960.06
    sulfolane 671.67
    2,2,4-trimethylpentane 33.78
    2-methyltetrahydrofuran 1063.84
    n-hexyl acetate 455.74
    isooctane 38.6
    2-(2-butoxyethoxy)ethanol 585.18
    sec-butyl acetate 412.78
    tert-butyl acetate 664.69
    decalin 40.38
    glycerin 496.95
    diglyme 1094.6
    acrylic acid 429.96
    isopropyl myristate 185.67
    n-butyric acid 652.44
    acetyl acetate 567.65
    di(2-ethylhexyl) phthalate 150.73
    ethyl propionate 506.17
    nitromethane 1248.51
    1,2-diethoxyethane 623.5
    benzonitrile 536.11
    trioctyl phosphate 114.38
    1-bromopropane 531.53
    gamma-valerolactone 1413.04
    n-decanol 171.46
    triethyl phosphate 160.66
    4-methyl-2-pentanol 369.25
    propionitrile 883.63
    vinylene carbonate 563.74
    1,1,2-trichlorotrifluoroethane 698.5
    DMS 501.53
    cumene 183.4
    2-octanol 209.35
    2-hexanone 571.6
    octyl acetate 222.54
    limonene 151.17
    1,2-dimethoxyethane 1385.31
    ethyl orthosilicate 158.6
    tributyl phosphate 137.03
    diacetone alcohol 703.76
    N,N-dimethylaniline 340.5
    acrylonitrile 1009.17
    aniline 532.03
    1,3-propanediol 894.72
    bromobenzene 470.0
    dibromomethane 780.63
    1,1,2,2-tetrachloroethane 1071.92
    2-methyl-cyclohexyl acetate 253.05
    tetrabutyl urea 160.31
    diisobutyl methanol 184.03
    2-phenylethanol 498.63
    styrene 301.69
    dioctyl adipate 190.09
    dimethyl sulfate 462.76
    ethyl butyrate 349.08
    methyl lactate 441.92
    butyl lactate 274.37
    diethyl carbonate 245.99
    propanediol butyl ether 457.16
    triethyl orthoformate 233.64
    p-tert-butyltoluene 140.49
    methyl 4-tert-butylbenzoate 349.5
    morpholine 1719.22
    tert-butylamine 604.47
    n-dodecanol 127.74
    dimethoxymethane 1248.58
    ethylene carbonate 498.67
    cyrene 295.71
    2-ethoxyethyl acetate 560.88
    2-ethylhexyl acetate 358.09
    1,2,4-trichlorobenzene 435.51
    4-methylpyridine 985.33
    dibutyl ether 254.43
    2,6-dimethyl-4-heptanol 184.03
    DEF 670.61
    dimethyl isosorbide 561.72
    tetrachloroethylene 665.54
    eugenol 364.43
    triacetin 351.8
    span 80 303.28
    1,4-butanediol 349.78
    1,1-dichloroethane 1135.03
    2-methyl-1-pentanol 369.6
    methyl formate 723.76
    2-methyl-1-butanol 573.49
    n-decane 33.18
    butyronitrile 785.77
    3,7-dimethyl-1-octanol 267.11
    1-chlorooctane 147.42
    1-chlorotetradecane 62.6
    n-nonane 30.27
    undecane 26.01
    tert-butylcyclohexane 48.31
    cyclooctane 23.44
    cyclopentanol 506.16
    tetrahydropyran 1135.86
    tert-amyl methyl ether 540.1
    2,5,8-trioxanonane 629.27
    1-hexene 181.24
    2-isopropoxyethanol 648.73
    2,2,2-trifluoroethanol 309.56
    methyl butyrate 605.78

    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