Furfuryl phenylacetate

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  • Identifiers

    CAS number
    36707-28-5

    Molecular formula
    C13H12O3

    SMILES
    C1=CC=C(C=C1)CC(=O)OCC2=CC=CO2

  • Odor profile

    Fragrance
    Honey 69.35%
    Floral 48.31%
    Sweet 46.04%
    Balsamic 42.55%
    Rose 42.04%
    Fruity 40.96%
    Caramellic 38.1%
    Cocoa 31.93%
    Spicy 31.88%
    Chocolate 29.78%

     

    Flavor
    Sweet 89.25%
    Floral 68.34%
    Fruity 64.62%
    Honey 56.69%
    Balsam 55.08%
    Rose 47.84%
    Chocolate 43.56%
    Waxy 39.87%
    Almond 37.42%
    Apricot 33.62%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    2.3

    pKa est.
    5.8 (weak acid)

    Molecular weight
    216.23 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    308°C

    Flash point

    • 142.78 ˚C est.

  • Synonyms

    • Furfuryl phenylacetate
    • 36707-28-5
    • furan-2-ylmethyl 2-phenylacetate
    • 7U97CB9DKA
    • Benzeneacetic acid, 2-furanylmethyl ester
    • NSC-9188
    • EINECS 253-164-2
    • DTXSID50190167
    • NSC 9188
    • 2-FURANYLMETHYL BENZENEACETATE
    • NSC9188
    • UNII-7U97CB9DKA
    • SCHEMBL11026060
    • DTXCID60112658
    • RQIJJMRWUPHQGB-UHFFFAOYSA-N
    • NS00030081
    • 253-164-2

  • Applications

    Furfuryl phenylacetate is primarily used as an odorant in perfumery, contributing specific note profiles and occasionally acting as a fixative in fragrance formulations. It is also employed as a fragrance ingredient in cosmetics and personal care products. In household products such as cleaners and air fresheners, it can serve as a fragrance additive to impart desirable scents. In industrial manufacturing, it may function as an intermediate in fragrance chemistry or related aroma compound synthesis. Its use is formulation- and regulation-dependent, and it should be handled per local regulations and limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 122.28
    methanol 229.82
    isopropanol 65.84
    water 0.27
    ethyl acetate 134.49
    n-propanol 82.86
    acetone 82.39
    n-butanol 56.09
    acetonitrile 207.76
    DMF 98.41
    toluene 39.12
    isobutanol 44.0
    1,4-dioxane 281.28
    methyl acetate 177.64
    THF 226.28
    2-butanone 128.9
    n-pentanol 56.45
    sec-butanol 64.13
    n-hexane 0.55
    ethylene glycol 61.27
    NMP 36.38
    cyclohexane 1.83
    DMSO 430.53
    n-butyl acetate 43.74
    n-octanol 21.15
    chloroform 276.04
    n-propyl acetate 64.37
    acetic acid 107.09
    dichloromethane 314.39
    cyclohexanone 67.41
    propylene glycol 102.35
    isopropyl acetate 53.55
    DMAc 283.71
    2-ethoxyethanol 194.15
    isopentanol 48.99
    n-heptane 1.6
    ethyl formate 62.48
    1,2-dichloroethane 193.97
    n-hexanol 36.47
    2-methoxyethanol 281.73
    isobutyl acetate 39.9
    tetrachloromethane 7.19
    n-pentyl acetate 21.21
    transcutol 649.38
    n-heptanol 18.21
    ethylbenzene 30.06
    MIBK 53.04
    2-propoxyethanol 116.9
    tert-butanol 81.17
    MTBE 56.55
    2-butoxyethanol 56.49
    propionic acid 73.16
    o-xylene 27.38
    formic acid 60.74
    diethyl ether 64.32
    m-xylene 23.53
    p-xylene 34.81
    chlorobenzene 53.05
    dimethyl carbonate 62.93
    n-octane 1.03
    formamide 142.98
    cyclopentanone 71.74
    2-pentanone 57.84
    anisole 120.54
    cyclopentyl methyl ether 47.64
    gamma-butyrolactone 113.53
    1-methoxy-2-propanol 181.77
    pyridine 214.74
    3-pentanone 63.19
    furfural 148.59
    n-dodecane 2.05
    diethylene glycol 127.73
    diisopropyl ether 12.52
    tert-amyl alcohol 66.21
    acetylacetone 116.97
    n-hexadecane 2.31
    acetophenone 91.89
    methyl propionate 102.51
    isopentyl acetate 47.42
    trichloroethylene 329.83
    n-nonanol 22.69
    cyclohexanol 38.4
    benzyl alcohol 87.61
    2-ethylhexanol 25.25
    isooctanol 17.73
    dipropyl ether 32.61
    1,2-dichlorobenzene 56.34
    ethyl lactate 43.98
    propylene carbonate 65.21
    n-methylformamide 72.73
    2-pentanol 33.15
    n-pentane 0.47
    1-propoxy-2-propanol 70.82
    1-methoxy-2-propyl acetate 76.68
    2-(2-methoxypropoxy) propanol 107.3
    mesitylene 14.2
    ε-caprolactone 67.54
    p-cymene 17.73
    epichlorohydrin 254.02
    1,1,1-trichloroethane 78.22
    2-aminoethanol 108.74
    morpholine-4-carbaldehyde 148.13
    sulfolane 118.26
    2,2,4-trimethylpentane 1.64
    2-methyltetrahydrofuran 91.37
    n-hexyl acetate 36.65
    isooctane 1.2
    2-(2-butoxyethoxy)ethanol 138.56
    sec-butyl acetate 44.0
    tert-butyl acetate 56.83
    decalin 3.39
    glycerin 119.58
    diglyme 270.45
    acrylic acid 75.96
    isopropyl myristate 24.01
    n-butyric acid 68.52
    acetyl acetate 77.01
    di(2-ethylhexyl) phthalate 27.56
    ethyl propionate 63.55
    nitromethane 256.3
    1,2-diethoxyethane 115.68
    benzonitrile 78.56
    trioctyl phosphate 15.17
    1-bromopropane 53.69
    gamma-valerolactone 132.79
    n-decanol 18.73
    triethyl phosphate 32.26
    4-methyl-2-pentanol 24.28
    propionitrile 118.57
    vinylene carbonate 71.22
    1,1,2-trichlorotrifluoroethane 149.12
    DMS 65.69
    cumene 20.37
    2-octanol 11.24
    2-hexanone 58.97
    octyl acetate 26.35
    limonene 20.04
    1,2-dimethoxyethane 265.16
    ethyl orthosilicate 29.6
    tributyl phosphate 21.81
    diacetone alcohol 86.15
    N,N-dimethylaniline 70.16
    acrylonitrile 168.18
    aniline 68.99
    1,3-propanediol 116.95
    bromobenzene 53.31
    dibromomethane 140.19
    1,1,2,2-tetrachloroethane 222.7
    2-methyl-cyclohexyl acetate 44.36
    tetrabutyl urea 33.62
    diisobutyl methanol 19.37
    2-phenylethanol 55.67
    styrene 43.91
    dioctyl adipate 42.95
    dimethyl sulfate 94.69
    ethyl butyrate 47.06
    methyl lactate 63.14
    butyl lactate 28.59
    diethyl carbonate 43.9
    propanediol butyl ether 63.71
    triethyl orthoformate 38.56
    p-tert-butyltoluene 15.76
    methyl 4-tert-butylbenzoate 67.06
    morpholine 265.72
    tert-butylamine 31.82
    n-dodecanol 15.87
    dimethoxymethane 178.42
    ethylene carbonate 54.51
    cyrene 77.8
    2-ethoxyethyl acetate 56.24
    2-ethylhexyl acetate 34.15
    1,2,4-trichlorobenzene 69.81
    4-methylpyridine 99.93
    dibutyl ether 33.13
    2,6-dimethyl-4-heptanol 19.37
    DEF 73.29
    dimethyl isosorbide 143.1
    tetrachloroethylene 105.47
    eugenol 71.21
    triacetin 73.42
    span 80 59.46
    1,4-butanediol 54.16
    1,1-dichloroethane 117.14
    2-methyl-1-pentanol 51.37
    methyl formate 65.02
    2-methyl-1-butanol 43.51
    n-decane 2.7
    butyronitrile 67.37
    3,7-dimethyl-1-octanol 28.76
    1-chlorooctane 13.62
    1-chlorotetradecane 7.57
    n-nonane 2.05
    undecane 2.3
    tert-butylcyclohexane 3.06
    cyclooctane 0.75
    cyclopentanol 32.96
    tetrahydropyran 114.81
    tert-amyl methyl ether 47.62
    2,5,8-trioxanonane 228.55
    1-hexene 7.54
    2-isopropoxyethanol 111.94
    2,2,2-trifluoroethanol 37.83
    methyl butyrate 71.96

    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