(R)-beta-bisabolene

  • Identifiers

    Molecular formula
    C15H24

    SMILES
    CC1=CC[C@@H](CC1)C(=C)CCC=C(C)C

  • Odor profile

    Fragrance
    Woody 72.56%
    Sweet 64.34%
    Floral 56.02%
    Citrus 53.86%
    Balsamic 52.38%
    Herbal 47.23%
    Tropical 45.65%
    Spicy 42.19%
    Fresh 41.81%
    Green 41.38%

     

    Flavor
    Woody 47.63%
    Wood 46.21%
    Herbal 39.38%
    Spice 35.34%
    Balsamic 34.76%
    Citrus 34.71%
    Spicy 34.45%
    Fresh 30.91%
    Balsam 30.23%
    Herb 28.65%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    5.2

    pKa est.
    8.81 (weak base)

    Molecular weight
    204.35 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    265°C

    Flash point

    • 105.29 ˚C est.

  • Synonyms

    • (R)-beta-bisabolene
    • (4r)-1-methyl-4-(6-methylhepta-1,5-dien-2-yl)cyclohexene
    • CHEBI:49266
    • 6-methyl-2-[(1R)-4-methyl-1-cyclohex-3-enyl]hepta-1,5-diene
    • (1R)-bisabola-4,7(11),10(15)-triene
    • (1R)-bisabola-4,7(11),10(15)-triene (4R)-1-methyl-4-(5-methyl-1-methylenehex-4-en-1-yl)cyclohexene
    • (4R)-1-methyl-4-(5-methyl-1-methylenehex-4-en-1-yl)cyclohexene
    • (R)-?-BISABOLENE
    • CHEMBL444389
    • LMPR0103060014
    • NS00126811
    • Q27121577
  • Applications

    (R)-beta-bisabolene is primarily used as a fragrance ingredient and odorant in perfumery, contributing a green, woody note to formulations. It is also employed as a fragrance component in cosmetics and personal care products, and in household products to impart a pleasant aroma. In industrial manufacturing, it serves as a chemical intermediate for the synthesis of other aroma chemicals and terpenoid derivatives used in fragrance portfolios. It may also be evaluated for use in coatings and inks as a scent additive, subject to formulation limits and regulatory requirements.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 718.94
    methanol 260.96
    isopropanol 678.59
    water 0.01
    ethyl acetate 2175.32
    n-propanol 684.04
    acetone 691.4
    n-butanol 1017.64
    acetonitrile 351.01
    DMF 254.42
    toluene 1951.73
    isobutanol 487.35
    1,4-dioxane 3112.58
    methyl acetate 749.44
    THF 3682.08
    2-butanone 1073.18
    n-pentanol 589.77
    sec-butanol 775.1
    n-hexane 1084.46
    ethylene glycol 13.73
    NMP 259.52
    cyclohexane 1455.77
    DMSO 274.57
    n-butyl acetate 2832.24
    n-octanol 359.09
    chloroform 1884.26
    n-propyl acetate 870.06
    acetic acid 161.65
    dichloromethane 1570.06
    cyclohexanone 1256.38
    propylene glycol 61.04
    isopropyl acetate 1621.44
    DMAc 430.97
    2-ethoxyethanol 521.04
    isopentanol 918.38
    n-heptane 1101.63
    ethyl formate 344.32
    1,2-dichloroethane 1210.8
    n-hexanol 1444.18
    2-methoxyethanol 663.61
    isobutyl acetate 643.37
    tetrachloromethane 369.12
    n-pentyl acetate 766.63
    transcutol 4265.4
    n-heptanol 397.46
    ethylbenzene 789.39
    MIBK 987.55
    2-propoxyethanol 1402.19
    tert-butanol 1062.71
    MTBE 3436.83
    2-butoxyethanol 536.73
    propionic acid 177.95
    o-xylene 735.07
    formic acid 18.3
    diethyl ether 4905.16
    m-xylene 1069.43
    p-xylene 697.52
    chlorobenzene 714.12
    dimethyl carbonate 149.35
    n-octane 233.1
    formamide 38.16
    cyclopentanone 805.74
    2-pentanone 1390.52
    anisole 1043.73
    cyclopentyl methyl ether 2053.81
    gamma-butyrolactone 540.11
    1-methoxy-2-propanol 717.18
    pyridine 1580.85
    3-pentanone 1016.24
    furfural 435.52
    n-dodecane 102.27
    diethylene glycol 298.98
    diisopropyl ether 1843.2
    tert-amyl alcohol 985.14
    acetylacetone 929.94
    n-hexadecane 123.64
    acetophenone 504.54
    methyl propionate 785.26
    isopentyl acetate 2482.42
    trichloroethylene 1515.68
    n-nonanol 375.74
    cyclohexanol 866.24
    benzyl alcohol 324.93
    2-ethylhexanol 1244.33
    isooctanol 354.0
    dipropyl ether 4300.86
    1,2-dichlorobenzene 539.64
    ethyl lactate 160.83
    propylene carbonate 416.16
    n-methylformamide 99.12
    2-pentanol 941.24
    n-pentane 879.64
    1-propoxy-2-propanol 1521.8
    1-methoxy-2-propyl acetate 2054.77
    2-(2-methoxypropoxy) propanol 718.64
    mesitylene 632.48
    ε-caprolactone 1041.05
    p-cymene 600.85
    epichlorohydrin 1305.57
    1,1,1-trichloroethane 1249.66
    2-aminoethanol 74.87
    morpholine-4-carbaldehyde 622.48
    sulfolane 409.17
    2,2,4-trimethylpentane 320.97
    2-methyltetrahydrofuran 3195.24
    n-hexyl acetate 1059.14
    isooctane 322.43
    2-(2-butoxyethoxy)ethanol 1053.15
    sec-butyl acetate 942.29
    tert-butyl acetate 1790.69
    decalin 458.11
    glycerin 61.6
    diglyme 2014.02
    acrylic acid 75.09
    isopropyl myristate 532.69
    n-butyric acid 701.93
    acetyl acetate 746.46
    di(2-ethylhexyl) phthalate 282.63
    ethyl propionate 848.08
    nitromethane 232.19
    1,2-diethoxyethane 4825.23
    benzonitrile 432.52
    trioctyl phosphate 175.44
    1-bromopropane 1839.32
    gamma-valerolactone 961.45
    n-decanol 274.26
    triethyl phosphate 434.54
    4-methyl-2-pentanol 582.2
    propionitrile 512.29
    vinylene carbonate 286.84
    1,1,2-trichlorotrifluoroethane 356.48
    DMS 456.88
    cumene 466.15
    2-octanol 280.11
    2-hexanone 943.3
    octyl acetate 521.72
    limonene 1148.84
    1,2-dimethoxyethane 1718.07
    ethyl orthosilicate 562.62
    tributyl phosphate 271.81
    diacetone alcohol 834.08
    N,N-dimethylaniline 571.63
    acrylonitrile 281.16
    aniline 779.09
    1,3-propanediol 254.13
    bromobenzene 975.44
    dibromomethane 1354.61
    1,1,2,2-tetrachloroethane 1382.3
    2-methyl-cyclohexyl acetate 954.19
    tetrabutyl urea 326.59
    diisobutyl methanol 762.12
    2-phenylethanol 677.96
    styrene 871.22
    dioctyl adipate 583.76
    dimethyl sulfate 120.09
    ethyl butyrate 2023.35
    methyl lactate 136.77
    butyl lactate 301.02
    diethyl carbonate 874.02
    propanediol butyl ether 290.63
    triethyl orthoformate 1336.87
    p-tert-butyltoluene 646.73
    methyl 4-tert-butylbenzoate 501.59
    morpholine 3074.1
    tert-butylamine 1100.88
    n-dodecanol 219.78
    dimethoxymethane 880.88
    ethylene carbonate 322.25
    cyrene 246.43
    2-ethoxyethyl acetate 1125.6
    2-ethylhexyl acetate 2113.98
    1,2,4-trichlorobenzene 593.59
    4-methylpyridine 1501.54
    dibutyl ether 2062.78
    2,6-dimethyl-4-heptanol 762.12
    DEF 979.8
    dimethyl isosorbide 1189.59
    tetrachloroethylene 777.35
    eugenol 331.5
    triacetin 584.86
    span 80 552.65
    1,4-butanediol 56.26
    1,1-dichloroethane 1215.36
    2-methyl-1-pentanol 667.3
    methyl formate 68.52
    2-methyl-1-butanol 757.27
    n-decane 215.02
    butyronitrile 894.43
    3,7-dimethyl-1-octanol 593.74
    1-chlorooctane 583.49
    1-chlorotetradecane 220.71
    n-nonane 239.52
    undecane 138.77
    tert-butylcyclohexane 432.93
    cyclooctane 609.77
    cyclopentanol 440.58
    tetrahydropyran 4651.04
    tert-amyl methyl ether 2287.79
    2,5,8-trioxanonane 1313.41
    1-hexene 1928.43
    2-isopropoxyethanol 491.28
    2,2,2-trifluoroethanol 25.7
    methyl butyrate 857.68

    Scent© AI

1 of 4
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