4-[2-(5-Hexyl-2-furanyl)ethyl]-2-methoxyphenol

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  • Identifiers

    CAS number
    143114-91-4

    Molecular formula
    C19H26O3

    SMILES
    CCCCCCC1=CC=C(O1)CCC2=CC(=C(C=C2)O)OC

    Safety labels

  • Odor profile

    Fragrance
    Spicy 56.46%
    Floral 43.22%
    Fruity 37.17%
    Sweet 37.14%
    Phenolic 33.93%
    Burnt 33.67%
    Balsamic 31.32%
    Smoky 30.34%
    Meaty 28.14%
    Vanilla 27.84%

     

    Flavor
    Spicy 43.88%
    Earthy 37.56%
    Spice 32.59%
    Phenolic 31.61%
    Herbal 31.19%
    Musty 30.57%
    Mild 30.16%
    Creamy 29.64%
    Burnt 29.24%
    Oily 28.76%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    5.7

    pKa est.
    9.74 (weak base)

    Molecular weight
    302.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    481°C

    Flash point

    • 180.9 ˚C est.

  • Synonyms

    • 143114-91-4
    • 4-[2-(5-Hexyl-2-furanyl)ethyl]-2-methoxyphenol
    • 4-(2-(5-Hexyl-2-furanyl)ethyl)-2-methoxyphenol
    • RefChem:287041
    • 2-Hexyl-5-[2-(4-hydroxy-3-methoxyphenyl)ethyl]furan
    • CHEBI:196276
    • DTXSID701248430
    • 4-[2-(5-Hexylfuran-2-yl)ethyl]-2-methoxyphenol
    • 4-[2-(5-hexyluran-2-yl)ethyl]-2-methoxyphenol
    • 4-[2-(5-Hexyl-2-furanyl)ethyl]-2-methoxyphenol, 9CI
    • 143114-91-4

  • Applications

    4-[2-(5-Hexyl-2-furanyl)ethyl]-2-methoxyphenol, CAS 143114-91-4, is viewed as a fragrance ingredient and may function as a fragrance fixative in perfumes, cosmetics, and personal care products; it serves as an intermediate in the synthesis of other aroma compounds and fragrance materials in the fragrance industry; it may be used as an aroma component in household and cleaning products; in industrial manufacturing, it can act as an intermediate or scent additive for coatings, inks, or polymer formulations; use is subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1444.81
    methanol 1757.71
    isopropanol 718.7
    water 0.04
    ethyl acetate 1487.63
    n-propanol 1004.81
    acetone 1537.49
    n-butanol 640.7
    acetonitrile 613.85
    DMF 567.52
    toluene 246.03
    isobutanol 466.82
    1,4-dioxane 1754.9
    methyl acetate 910.25
    THF 2194.03
    2-butanone 1043.31
    n-pentanol 335.66
    sec-butanol 489.87
    n-hexane 5.46
    ethylene glycol 56.8
    NMP 160.0
    cyclohexane 37.29
    DMSO 1662.47
    n-butyl acetate 398.18
    n-octanol 69.83
    chloroform 1676.73
    n-propyl acetate 490.9
    acetic acid 456.47
    dichloromethane 2274.66
    cyclohexanone 866.01
    propylene glycol 158.46
    isopropyl acetate 617.56
    DMAc 597.14
    2-ethoxyethanol 897.51
    isopentanol 406.47
    n-heptane 6.19
    ethyl formate 433.45
    1,2-dichloroethane 1516.79
    n-hexanol 202.13
    2-methoxyethanol 1434.11
    isobutyl acetate 318.26
    tetrachloromethane 116.78
    n-pentyl acetate 221.57
    transcutol 1683.63
    n-heptanol 78.57
    ethylbenzene 89.69
    MIBK 372.43
    2-propoxyethanol 592.62
    tert-butanol 701.94
    MTBE 824.52
    2-butoxyethanol 240.9
    propionic acid 324.38
    o-xylene 95.06
    formic acid 94.31
    diethyl ether 1147.12
    m-xylene 109.71
    p-xylene 114.24
    chlorobenzene 312.6
    dimethyl carbonate 202.87
    n-octane 5.82
    formamide 251.19
    cyclopentanone 784.51
    2-pentanone 842.81
    anisole 294.7
    cyclopentyl methyl ether 498.43
    gamma-butyrolactone 754.18
    1-methoxy-2-propanol 818.83
    pyridine 775.17
    3-pentanone 459.47
    furfural 495.02
    n-dodecane 6.9
    diethylene glycol 339.04
    diisopropyl ether 118.05
    tert-amyl alcohol 434.92
    acetylacetone 882.19
    n-hexadecane 8.13
    acetophenone 246.9
    methyl propionate 682.02
    isopentyl acetate 365.08
    trichloroethylene 1718.15
    n-nonanol 73.1
    cyclohexanol 348.81
    benzyl alcohol 234.0
    2-ethylhexanol 93.57
    isooctanol 76.95
    dipropyl ether 168.74
    1,2-dichlorobenzene 244.82
    ethyl lactate 137.19
    propylene carbonate 353.3
    n-methylformamide 365.88
    2-pentanol 270.38
    n-pentane 5.91
    1-propoxy-2-propanol 315.75
    1-methoxy-2-propyl acetate 430.22
    2-(2-methoxypropoxy) propanol 221.9
    mesitylene 60.04
    ε-caprolactone 630.37
    p-cymene 48.97
    epichlorohydrin 1709.08
    1,1,1-trichloroethane 748.56
    2-aminoethanol 242.6
    morpholine-4-carbaldehyde 469.78
    sulfolane 575.86
    2,2,4-trimethylpentane 10.91
    2-methyltetrahydrofuran 938.5
    n-hexyl acetate 231.33
    isooctane 8.08
    2-(2-butoxyethoxy)ethanol 365.72
    sec-butyl acetate 306.81
    tert-butyl acetate 540.46
    decalin 15.19
    glycerin 161.64
    diglyme 831.24
    acrylic acid 179.61
    isopropyl myristate 89.88
    n-butyric acid 702.93
    acetyl acetate 487.35
    di(2-ethylhexyl) phthalate 79.88
    ethyl propionate 374.07
    nitromethane 1005.56
    1,2-diethoxyethane 638.26
    benzonitrile 244.34
    trioctyl phosphate 53.98
    1-bromopropane 639.11
    gamma-valerolactone 1132.22
    n-decanol 54.46
    triethyl phosphate 101.29
    4-methyl-2-pentanol 128.96
    propionitrile 472.99
    vinylene carbonate 312.41
    1,1,2-trichlorotrifluoroethane 496.95
    DMS 228.95
    cumene 55.02
    2-octanol 59.78
    2-hexanone 403.25
    octyl acetate 111.09
    limonene 71.85
    1,2-dimethoxyethane 1264.35
    ethyl orthosilicate 107.84
    tributyl phosphate 79.93
    diacetone alcohol 424.62
    N,N-dimethylaniline 120.05
    acrylonitrile 477.5
    aniline 268.81
    1,3-propanediol 522.02
    bromobenzene 351.13
    dibromomethane 1218.27
    1,1,2,2-tetrachloroethane 1236.58
    2-methyl-cyclohexyl acetate 171.23
    tetrabutyl urea 96.4
    diisobutyl methanol 68.19
    2-phenylethanol 189.77
    styrene 133.36
    dioctyl adipate 140.23
    dimethyl sulfate 226.39
    ethyl butyrate 256.58
    methyl lactate 162.71
    butyl lactate 144.49
    diethyl carbonate 179.02
    propanediol butyl ether 175.93
    triethyl orthoformate 169.03
    p-tert-butyltoluene 47.94
    methyl 4-tert-butylbenzoate 176.76
    morpholine 2048.62
    tert-butylamine 274.81
    n-dodecanol 42.93
    dimethoxymethane 1085.64
    ethylene carbonate 326.2
    cyrene 170.56
    2-ethoxyethyl acetate 425.61
    2-ethylhexyl acetate 239.99
    1,2,4-trichlorobenzene 252.5
    4-methylpyridine 563.21
    dibutyl ether 158.3
    2,6-dimethyl-4-heptanol 68.19
    DEF 496.9
    dimethyl isosorbide 355.92
    tetrachloroethylene 675.87
    eugenol 179.1
    triacetin 248.72
    span 80 160.43
    1,4-butanediol 162.99
    1,1-dichloroethane 1138.24
    2-methyl-1-pentanol 252.0
    methyl formate 268.94
    2-methyl-1-butanol 339.37
    n-decane 11.21
    butyronitrile 535.12
    3,7-dimethyl-1-octanol 89.44
    1-chlorooctane 60.38
    1-chlorotetradecane 25.65
    n-nonane 9.05
    undecane 8.44
    tert-butylcyclohexane 13.44
    cyclooctane 6.92
    cyclopentanol 284.47
    tetrahydropyran 1721.25
    tert-amyl methyl ether 364.85
    2,5,8-trioxanonane 480.78
    1-hexene 61.96
    2-isopropoxyethanol 484.21
    2,2,2-trifluoroethanol 99.35
    methyl butyrate 501.22

    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