Eriobofuran

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  • Identifiers

    CAS number
    97218-06-9

    Molecular formula
    C14H12O4

    SMILES
    COC1=C(C(=C2C(=C1)C3=CC=CC=C3O2)OC)O

    Safety labels

  • Odor profile

    Fragrance
    Phenolic 66.72%
    Spicy 57.18%
    Smoky 50.99%
    Vanilla 45.39%
    Burnt 45.24%
    Balsamic 37.01%
    Woody 35.94%
    Sweet 34.77%
    Medicinal 33.11%
    Powdery 32.59%

     

    Flavor
    Bitter 79.28%
    Phenolic 25.5%
    Eugenol 24.12%
    Smoky 24.03%
    Smoke 23.06%
    Parsley 22.57%
    Vanilla 21.52%
    Allspice 21.11%
    Ham 20.91%
    Spice 20.79%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    3.3

    pKa est.
    7.25 (neutral)

    Molecular weight
    244.24 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    461°C

    Melting point expt.

    • 157 - 158 °C

    Flash point

    • 199.1 ˚C est.

  • Synonyms

    • Eriobofuran
    • 97218-06-9
    • 2,4-dimethoxydibenzofuran-3-ol
    • 3-Dibenzofuranol, 2,4-dimethoxy-
    • 2,4-dimethoxydibenzo[b,d]furan-3-ol
    • GGW289WMG9
    • UNII-GGW289WMG9
    • C08743
    • CHEBI:4829
    • orb1681054
    • 2,4-Dimethoxy-3-dibenzofuranol
    • CHEMBL1080122
    • SCHEMBL30207098
    • DTXSID60242782
    • XDA21806
    • 3-hydroxy-2,4-dimethoxydibenzofuran
    • HY-N10101
    • AKOS040762841
    • 2,4-Dimethoxy-3-dibenzofuranol, 9CI
    • DA-52975
    • CS-0255568
    • H64029
    • Q27106495
    • 4,6-dimethoxy-8-oxatricyclo[7.4.0.0^{2,7}]trideca-1(13),2,4,6,9,11-hexaen-5-ol
    • 97218-06-9

  • Applications

    Eriobofuran (CAS 97218-06-9) can function as an intermediate in organic synthesis and may serve a range of practical applications across industries; specifically, it may act as an odorant or fragrance component in perfumery and personal care; may be used as a solvent or co-solvent in cleaning formulations and household products; as a precursor for specialty polymers and plastics; as an additive or processing aid in coatings and inks; and as an intermediate in pharmaceutical development.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 12.35
    methanol 9.39
    isopropanol 8.18
    water 0.05
    ethyl acetate 22.93
    n-propanol 10.47
    acetone 28.54
    n-butanol 10.27
    acetonitrile 8.93
    DMF 60.16
    toluene 11.82
    isobutanol 8.53
    1,4-dioxane 51.17
    methyl acetate 25.46
    THF 86.63
    2-butanone 24.53
    n-pentanol 10.53
    sec-butanol 7.81
    n-hexane 0.78
    ethylene glycol 7.98
    NMP 60.52
    cyclohexane 2.96
    DMSO 54.82
    n-butyl acetate 20.49
    n-octanol 10.49
    chloroform 48.29
    n-propyl acetate 22.74
    acetic acid 30.44
    dichloromethane 67.67
    cyclohexanone 46.29
    propylene glycol 4.01
    isopropyl acetate 17.19
    DMAc 57.16
    2-ethoxyethanol 34.07
    isopentanol 12.09
    n-heptane 1.81
    ethyl formate 20.75
    1,2-dichloroethane 51.39
    n-hexanol 14.0
    2-methoxyethanol 46.9
    isobutyl acetate 18.46
    tetrachloromethane 7.87
    n-pentyl acetate 22.65
    transcutol 68.95
    n-heptanol 13.4
    ethylbenzene 10.34
    MIBK 15.3
    2-propoxyethanol 39.9
    tert-butanol 13.66
    MTBE 11.35
    2-butoxyethanol 33.02
    propionic acid 16.3
    o-xylene 10.49
    formic acid 14.92
    diethyl ether 13.88
    m-xylene 9.26
    p-xylene 13.94
    chlorobenzene 21.58
    dimethyl carbonate 27.14
    n-octane 1.48
    formamide 38.1
    cyclopentanone 56.55
    2-pentanone 19.71
    anisole 24.25
    cyclopentyl methyl ether 26.51
    gamma-butyrolactone 73.3
    1-methoxy-2-propanol 24.64
    pyridine 58.38
    3-pentanone 17.62
    furfural 80.56
    n-dodecane 1.45
    diethylene glycol 42.13
    diisopropyl ether 5.16
    tert-amyl alcohol 11.91
    acetylacetone 32.67
    n-hexadecane 1.67
    acetophenone 31.5
    methyl propionate 23.81
    isopentyl acetate 22.45
    trichloroethylene 94.8
    n-nonanol 11.46
    cyclohexanol 15.39
    benzyl alcohol 26.77
    2-ethylhexanol 12.0
    isooctanol 12.29
    dipropyl ether 11.2
    1,2-dichlorobenzene 26.71
    ethyl lactate 14.76
    propylene carbonate 39.64
    n-methylformamide 25.6
    2-pentanol 6.85
    n-pentane 0.91
    1-propoxy-2-propanol 21.12
    1-methoxy-2-propyl acetate 28.05
    2-(2-methoxypropoxy) propanol 27.36
    mesitylene 6.3
    ε-caprolactone 43.41
    p-cymene 9.52
    epichlorohydrin 92.12
    1,1,1-trichloroethane 25.9
    2-aminoethanol 10.6
    morpholine-4-carbaldehyde 71.91
    sulfolane 79.71
    2,2,4-trimethylpentane 1.12
    2-methyltetrahydrofuran 37.28
    n-hexyl acetate 22.45
    isooctane 0.73
    2-(2-butoxyethoxy)ethanol 35.49
    sec-butyl acetate 15.18
    tert-butyl acetate 19.21
    decalin 2.22
    glycerin 14.42
    diglyme 75.46
    acrylic acid 22.01
    isopropyl myristate 11.04
    n-butyric acid 21.53
    acetyl acetate 21.2
    di(2-ethylhexyl) phthalate 14.77
    ethyl propionate 18.65
    nitromethane 51.81
    1,2-diethoxyethane 26.73
    benzonitrile 24.08
    trioctyl phosphate 10.55
    1-bromopropane 14.68
    gamma-valerolactone 77.51
    n-decanol 9.12
    triethyl phosphate 16.08
    4-methyl-2-pentanol 6.56
    propionitrile 11.62
    vinylene carbonate 44.47
    1,1,2-trichlorotrifluoroethane 65.64
    DMS 29.86
    cumene 8.47
    2-octanol 8.99
    2-hexanone 20.16
    octyl acetate 13.84
    limonene 11.42
    1,2-dimethoxyethane 63.86
    ethyl orthosilicate 15.94
    tributyl phosphate 11.65
    diacetone alcohol 25.31
    N,N-dimethylaniline 19.57
    acrylonitrile 20.91
    aniline 20.24
    1,3-propanediol 18.43
    bromobenzene 21.3
    dibromomethane 32.22
    1,1,2,2-tetrachloroethane 60.7
    2-methyl-cyclohexyl acetate 22.19
    tetrabutyl urea 17.07
    diisobutyl methanol 8.14
    2-phenylethanol 27.93
    styrene 11.67
    dioctyl adipate 18.11
    dimethyl sulfate 40.74
    ethyl butyrate 18.06
    methyl lactate 16.62
    butyl lactate 17.53
    diethyl carbonate 16.71
    propanediol butyl ether 19.13
    triethyl orthoformate 17.45
    p-tert-butyltoluene 8.92
    methyl 4-tert-butylbenzoate 29.86
    morpholine 50.48
    tert-butylamine 8.12
    n-dodecanol 7.33
    dimethoxymethane 54.39
    ethylene carbonate 33.32
    cyrene 37.11
    2-ethoxyethyl acetate 33.92
    2-ethylhexyl acetate 18.68
    1,2,4-trichlorobenzene 31.2
    4-methylpyridine 35.19
    dibutyl ether 12.22
    2,6-dimethyl-4-heptanol 8.14
    DEF 29.62
    dimethyl isosorbide 50.34
    tetrachloroethylene 56.21
    eugenol 33.02
    triacetin 29.13
    span 80 21.26
    1,4-butanediol 9.14
    1,1-dichloroethane 22.45
    2-methyl-1-pentanol 13.26
    methyl formate 30.38
    2-methyl-1-butanol 10.38
    n-decane 2.24
    butyronitrile 11.17
    3,7-dimethyl-1-octanol 10.19
    1-chlorooctane 7.93
    1-chlorotetradecane 3.98
    n-nonane 1.87
    undecane 1.73
    tert-butylcyclohexane 1.78
    cyclooctane 1.3
    cyclopentanol 17.27
    tetrahydropyran 32.54
    tert-amyl methyl ether 10.5
    2,5,8-trioxanonane 54.47
    1-hexene 3.84
    2-isopropoxyethanol 25.25
    2,2,2-trifluoroethanol 18.23
    methyl butyrate 25.47

    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