Evodol

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    22318-10-1

    Molecular formula
    C26H28O9

    SMILES
    C[C@@]12CC[C@H]3[C@]([C@@]14[C@H](O4)C(=O)O[C@H]2C5=COC=C5)(C(=O)C(=C6[C@@]37COC(=O)C[C@@H]7OC6(C)C)O)C

  • Odor profile

    Sweet 40.66%
    Odorless 34.72%
    Woody 30.02%
    Spicy 25.1%
    Nutty 24.38%
    Coumarinic 24.02%
    Lactonic 23.56%
    Tobacco 22.1%
    Coconut 21.99%
    Caramellic 21.86%

    Scent© AI

  • Properties

    XLogP3-AA
    1.2

    pKa est.
    4.95 (weak acid)

    Molecular weight
    484.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    1623°C

    Flash point est.
    193.76 ˚C

  • Synonyms

    • Evodol
    • 22318-10-1
    • LIMONIN DIOSPHENOL
    • (1R,2R,7S,13R,14R,16S,19S,20S)-19-(furan-3-yl)-11-hydroxy-9,9,13,20-tetramethyl-4,8,15,18-tetraoxahexacyclo[11.9.0.02,7.02,10.014,16.014,20]docos-10-ene-5,12,17-trione
    • Glaucin C
    • (4aS,8aR,8bR,9aS,12S,12aS,14aR,14bR)-12-(Furan-3-yl)-7-hydroxy-6,6,8a,12a-tetramethyl-4,4a,9a,12,12a,13,14,14a-octahydrooxireno[2,3-d]pyrano[4',3':3,3a]isobenzofuro[5,4-f]isochromene-3,8,10(1H,6H,8aH)-trione
    • DTXSID60904237
    • Evodol;NSC 314322;Glaucin C
    • HY-N2621
    • AKOS037514644
    • FS-9610
    • NSC 314322
    • DA-53076
    • XL161810
    • CS-0023027
    • 11H,13H-Oxireno(d)pyrano(4',3':3,3a)isobenzofuro(5,4-f)(2)benzopyran-4,6,13(2H,5aH)-trione, 8-(3-furanyl)-4a,8,8a,9,10,10a,14,14a-octahydro-3-hydroxy-2,2,4a,8a-tetramethyl-, (4aR-(4aalpha,4bR*,5abeta,8beta,8abeta,10abeta,10bR*,14abeta))-

  • Applications

    Evodol (CAS 22318-10-1) is used primarily in research and quality control: as an analytical reference standard for developing, validating, and calibrating HPLC/LC–MS/GC methods in pharmaceuticals, botanicals, and QC; as a starting material/intermediate to prepare derivatives for structure–activity relationship (SAR) studies and lead optimization; as a pharmacological probe in vitro/in vivo to screen for biological potential (e.g., anti-inflammatory/antioxidant/antimicrobial, enzyme or receptor modulation) per study design; in formulation work (solubility, stability, permeability, delivery systems) and impurity/purity profiling; for authentication and standardization of natural sources in metabolomics; in safety toxicology and preclinical ADME profiling; and for training, system suitability, and instrument calibration; note it is not an approved therapeutic, use is restricted to laboratory settings, and identity should be verified by CAS/COA because trade names can be ambiguous.

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 0.18
    methanol 0.73
    isopropanol 0.07
    water 0.01
    ethyl acetate 1.65
    n-propanol 0.15
    acetone 5.63
    n-butanol 0.1
    acetonitrile 9.41
    DMF 10.95
    toluene 0.67
    isobutanol 0.1
    1,4-dioxane 4.2
    methyl acetate 3.18
    THF 5.78
    2-butanone 2.35
    n-pentanol 0.15
    sec-butanol 0.06
    n-hexane 0.01
    ethylene glycol 0.41
    NMP 22.96
    cyclohexane 0.02
    DMSO 15.24
    n-butyl acetate 1.01
    n-octanol 0.16
    chloroform 5.74
    n-propyl acetate 1.37
    acetic acid 5.06
    dichloromethane 5.75
    cyclohexanone 5.33
    propylene glycol 0.15
    isopropyl acetate 1.05
    DMAc 14.51
    2-ethoxyethanol 1.46
    isopentanol 0.12
    n-heptane 0.01
    ethyl formate 2.04
    1,2-dichloroethane 2.76
    n-hexanol 0.15
    2-methoxyethanol 1.97
    isobutyl acetate 0.96
    tetrachloromethane 0.48
    n-pentyl acetate 1.03
    transcutol 1.87
    n-heptanol 0.2
    ethylbenzene 0.26
    MIBK 1.01
    2-propoxyethanol 2.35
    tert-butanol 0.11
    MTBE 0.17
    2-butoxyethanol 1.52
    propionic acid 1.17
    o-xylene 0.39
    formic acid 3.86
    diethyl ether 0.27
    m-xylene 0.38
    p-xylene 0.52
    chlorobenzene 1.8
    dimethyl carbonate 3.98
    n-octane 0.01
    formamide 6.18
    cyclopentanone 10.54
    2-pentanone 1.3
    anisole 1.03
    cyclopentyl methyl ether 0.8
    gamma-butyrolactone 13.4
    1-methoxy-2-propanol 0.95
    pyridine 6.42
    3-pentanone 1.49
    furfural 14.33
    n-dodecane 0.01
    diethylene glycol 3.05
    diisopropyl ether 0.08
    tert-amyl alcohol 0.09
    acetylacetone 5.8
    n-hexadecane 0.01
    acetophenone 2.66
    methyl propionate 2.15
    isopentyl acetate 0.96
    trichloroethylene 10.11
    n-nonanol 0.21
    cyclohexanol 0.17
    benzyl alcohol 1.2
    2-ethylhexanol 0.14
    isooctanol 0.2
    dipropyl ether 0.24
    1,2-dichlorobenzene 1.83
    ethyl lactate 1.19
    propylene carbonate 4.68
    n-methylformamide 5.18
    2-pentanol 0.04
    n-pentane 0.01
    1-propoxy-2-propanol 1.02
    1-methoxy-2-propyl acetate 2.37
    2-(2-methoxypropoxy) propanol 1.82
    mesitylene 0.2
    ε-caprolactone 3.73
    p-cymene 0.22
    epichlorohydrin 10.42
    1,1,1-trichloroethane 2.26
    2-aminoethanol 0.39
    morpholine-4-carbaldehyde 13.94
    sulfolane 20.55
    2,2,4-trimethylpentane 0.0
    2-methyltetrahydrofuran 1.28
    n-hexyl acetate 0.98
    isooctane 0.0
    2-(2-butoxyethoxy)ethanol 1.8
    sec-butyl acetate 0.68
    tert-butyl acetate 1.11
    decalin 0.02
    glycerin 0.88
    diglyme 4.06
    acrylic acid 2.97
    isopropyl myristate 0.39
    n-butyric acid 1.04
    acetyl acetate 3.51
    di(2-ethylhexyl) phthalate 1.13
    ethyl propionate 1.21
    nitromethane 28.99
    1,2-diethoxyethane 0.74
    benzonitrile 3.58
    trioctyl phosphate 0.6
    1-bromopropane 0.33
    gamma-valerolactone 18.05
    n-decanol 0.14
    triethyl phosphate 0.85
    4-methyl-2-pentanol 0.07
    propionitrile 2.31
    vinylene carbonate 6.87
    1,1,2-trichlorotrifluoroethane 9.13
    DMS 2.24
    cumene 0.17
    2-octanol 0.09
    2-hexanone 1.4
    octyl acetate 0.61
    limonene 0.21
    1,2-dimethoxyethane 3.31
    ethyl orthosilicate 0.62
    tributyl phosphate 0.58
    diacetone alcohol 1.62
    N,N-dimethylaniline 0.72
    acrylonitrile 7.1
    aniline 0.91
    1,3-propanediol 0.45
    bromobenzene 1.76
    dibromomethane 2.13
    1,1,2,2-tetrachloroethane 4.48
    2-methyl-cyclohexyl acetate 1.25
    tetrabutyl urea 1.15
    diisobutyl methanol 0.09
    2-phenylethanol 1.54
    styrene 0.38
    dioctyl adipate 1.04
    dimethyl sulfate 8.27
    ethyl butyrate 0.93
    methyl lactate 2.12
    butyl lactate 0.99
    diethyl carbonate 0.97
    propanediol butyl ether 0.88
    triethyl orthoformate 0.76
    p-tert-butyltoluene 0.18
    methyl 4-tert-butylbenzoate 2.16
    morpholine 2.71
    tert-butylamine 0.04
    n-dodecanol 0.1
    dimethoxymethane 4.22
    ethylene carbonate 4.52
    cyrene 5.62
    2-ethoxyethyl acetate 2.38
    2-ethylhexyl acetate 0.78
    1,2,4-trichlorobenzene 2.89
    4-methylpyridine 3.82
    dibutyl ether 0.15
    2,6-dimethyl-4-heptanol 0.09
    DEF 2.24
    dimethyl isosorbide 4.97
    tetrachloroethylene 3.24
    eugenol 2.56
    triacetin 2.52
    span 80 1.36
    1,4-butanediol 0.33
    1,1-dichloroethane 1.44
    2-methyl-1-pentanol 0.16
    methyl formate 5.94
    2-methyl-1-butanol 0.1
    n-decane 0.01
    butyronitrile 1.08
    3,7-dimethyl-1-octanol 0.17
    1-chlorooctane 0.09
    1-chlorotetradecane 0.04
    n-nonane 0.01
    undecane 0.01
    tert-butylcyclohexane 0.01
    cyclooctane 0.01
    cyclopentanol 0.32
    tetrahydropyran 0.84
    tert-amyl methyl ether 0.15
    2,5,8-trioxanonane 3.42
    1-hexene 0.04
    2-isopropoxyethanol 0.98
    2,2,2-trifluoroethanol 3.79
    methyl butyrate 1.46

    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
Hortensis leaf Euodia hortensis forma hortensis, fam. Saxifragaceae (Hydrangea) 0.05%