Zedoarol

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    103994-22-5

    Molecular formula
    C15H18O3

    SMILES
    C[C@H]1CC[C@@H]2[C@@]1(C(=O)C3=C(CC2=C)OC=C3C)O

  • Odor profile

    Woody 33.23%
    Spicy 30.68%
    Odorless 30.55%
    Burnt 30.45%
    Sweet 29.45%
    Caramellic 27.73%
    Phenolic 27.65%
    Mint 23.63%
    Tobacco 21.4%
    Roasted 21.09%

    Scent© AI

  • Properties

    XLogP3-AA
    2.2

    Molecular weight
    246.3 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    490°C

    Flash point est.
    161.58 ˚C

  • Synonyms

    • Zedoarol
    • CHEBI:81128
    • DTXSID401113272
    • 103994-22-5
    • C17490
    • Q27155086
    • (4aS,5S,7aS)-5,6,7,7a,8,9-Hexahydro-4a-hydroxy-3,5-dimethyl-8-methyleneazuleno[6,5-b]furan-4(4aH)-one

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 73.06
    methanol 108.76
    isopropanol 117.69
    water 0.39
    ethyl acetate 57.42
    n-propanol 100.91
    acetone 134.74
    n-butanol 115.21
    acetonitrile 34.15
    DMF 371.03
    toluene 123.26
    isobutanol 94.58
    1,4-dioxane 192.2
    methyl acetate 81.93
    THF 328.39
    2-butanone 161.19
    n-pentanol 82.93
    sec-butanol 89.28
    n-hexane 1.04
    ethylene glycol 30.0
    NMP 200.88
    cyclohexane 4.67
    DMSO 169.98
    n-butyl acetate 67.75
    n-octanol 47.41
    chloroform 310.73
    n-propyl acetate 62.1
    acetic acid 67.35
    dichloromethane 233.13
    cyclohexanone 257.37
    propylene glycol 37.52
    isopropyl acetate 54.67
    DMAc 227.24
    2-ethoxyethanol 120.07
    isopentanol 107.43
    n-heptane 1.71
    ethyl formate 89.91
    1,2-dichloroethane 121.54
    n-hexanol 80.82
    2-methoxyethanol 195.64
    isobutyl acetate 59.3
    tetrachloromethane 35.91
    n-pentyl acetate 83.04
    transcutol 137.29
    n-heptanol 57.37
    ethylbenzene 49.12
    MIBK 83.74
    2-propoxyethanol 146.39
    tert-butanol 110.34
    MTBE 40.77
    2-butoxyethanol 110.51
    propionic acid 62.43
    o-xylene 64.96
    formic acid 33.28
    diethyl ether 30.03
    m-xylene 73.45
    p-xylene 78.09
    chlorobenzene 122.0
    dimethyl carbonate 54.41
    n-octane 1.94
    formamide 64.16
    cyclopentanone 298.25
    2-pentanone 109.97
    anisole 86.43
    cyclopentyl methyl ether 80.1
    gamma-butyrolactone 219.89
    1-methoxy-2-propanol 167.98
    pyridine 255.89
    3-pentanone 70.08
    furfural 248.21
    n-dodecane 2.86
    diethylene glycol 133.46
    diisopropyl ether 12.98
    tert-amyl alcohol 70.57
    acetylacetone 123.28
    n-hexadecane 3.44
    acetophenone 108.81
    methyl propionate 64.53
    isopentyl acetate 76.71
    trichloroethylene 277.19
    n-nonanol 46.47
    cyclohexanol 105.47
    benzyl alcohol 141.62
    2-ethylhexanol 44.18
    isooctanol 51.76
    dipropyl ether 19.27
    1,2-dichlorobenzene 105.52
    ethyl lactate 49.46
    propylene carbonate 134.88
    n-methylformamide 123.31
    2-pentanol 58.24
    n-pentane 1.59
    1-propoxy-2-propanol 88.82
    1-methoxy-2-propyl acetate 80.17
    2-(2-methoxypropoxy) propanol 81.22
    mesitylene 37.63
    ε-caprolactone 168.38
    p-cymene 33.5
    epichlorohydrin 253.23
    1,1,1-trichloroethane 110.3
    2-aminoethanol 56.39
    morpholine-4-carbaldehyde 240.28
    sulfolane 225.9
    2,2,4-trimethylpentane 2.58
    2-methyltetrahydrofuran 133.74
    n-hexyl acetate 90.55
    isooctane 2.52
    2-(2-butoxyethoxy)ethanol 101.5
    sec-butyl acetate 47.25
    tert-butyl acetate 60.92
    decalin 4.55
    glycerin 67.23
    diglyme 166.02
    acrylic acid 62.91
    isopropyl myristate 39.32
    n-butyric acid 102.21
    acetyl acetate 52.32
    di(2-ethylhexyl) phthalate 57.02
    ethyl propionate 47.0
    nitromethane 105.72
    1,2-diethoxyethane 60.17
    benzonitrile 155.08
    trioctyl phosphate 39.8
    1-bromopropane 51.73
    gamma-valerolactone 333.63
    n-decanol 35.29
    triethyl phosphate 33.27
    4-methyl-2-pentanol 42.98
    propionitrile 62.63
    vinylene carbonate 150.85
    1,1,2-trichlorotrifluoroethane 153.33
    DMS 75.38
    cumene 35.54
    2-octanol 44.5
    2-hexanone 85.45
    octyl acetate 49.44
    limonene 33.95
    1,2-dimethoxyethane 171.88
    ethyl orthosilicate 31.83
    tributyl phosphate 39.97
    diacetone alcohol 103.41
    N,N-dimethylaniline 64.49
    acrylonitrile 90.77
    aniline 123.15
    1,3-propanediol 110.42
    bromobenzene 121.59
    dibromomethane 122.95
    1,1,2,2-tetrachloroethane 197.39
    2-methyl-cyclohexyl acetate 61.75
    tetrabutyl urea 60.84
    diisobutyl methanol 28.0
    2-phenylethanol 131.23
    styrene 54.99
    dioctyl adipate 54.48
    dimethyl sulfate 81.14
    ethyl butyrate 47.23
    methyl lactate 57.38
    butyl lactate 69.27
    diethyl carbonate 37.43
    propanediol butyl ether 91.03
    triethyl orthoformate 40.57
    p-tert-butyltoluene 30.08
    methyl 4-tert-butylbenzoate 92.18
    morpholine 206.95
    tert-butylamine 45.59
    n-dodecanol 26.36
    dimethoxymethane 160.79
    ethylene carbonate 117.76
    cyrene 125.62
    2-ethoxyethyl acetate 93.59
    2-ethylhexyl acetate 61.77
    1,2,4-trichlorobenzene 124.18
    4-methylpyridine 236.62
    dibutyl ether 28.23
    2,6-dimethyl-4-heptanol 28.0
    DEF 95.8
    dimethyl isosorbide 133.67
    tetrachloroethylene 131.14
    eugenol 110.48
    triacetin 77.14
    span 80 76.84
    1,4-butanediol 58.93
    1,1-dichloroethane 120.01
    2-methyl-1-pentanol 81.3
    methyl formate 116.3
    2-methyl-1-butanol 91.58
    n-decane 4.17
    butyronitrile 80.95
    3,7-dimethyl-1-octanol 45.07
    1-chlorooctane 23.52
    1-chlorotetradecane 11.18
    n-nonane 3.09
    undecane 3.39
    tert-butylcyclohexane 4.17
    cyclooctane 1.87
    cyclopentanol 120.01
    tetrahydropyran 138.14
    tert-amyl methyl ether 31.09
    2,5,8-trioxanonane 126.89
    1-hexene 9.08
    2-isopropoxyethanol 93.39
    2,2,2-trifluoroethanol 37.48
    methyl butyrate 75.81

    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

Botanical

Name CAS Botanical Proportion
Curcuma aeruginosa (Malaysia) 1 Curcuma aeruginosa Roxb., fam. Zingiberaceae 6.4%