2-Propen-1-one, 1-(2-furanyl)-

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  • Identifiers

    CAS number
    14123-26-3

    Molecular formula
    C7H6O2

    SMILES
    C=CC(=O)C1=CC=CO1

  • Odor profile

    Fragrance
    Caramellic 64.09%
    Spicy 53.22%
    Burnt 52.56%
    Nutty 52.25%
    Sweet 45.69%
    Coffee 37.43%
    Roasted 34.57%
    Woody 34.37%
    Almond 34.18%
    Pungent 31.97%

     

    Flavor
    Nutty 43.18%
    Popcorn 35.12%
    Bread 31.27%
    Caramel 25.83%
    Corn 25.31%
    Odorless 25.0%
    Roast 24.8%
    Musty 24.35%
    Chip 24.14%
    Bread crust 23.65%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    1.1

    pKa est.
    6.07 (neutral)

    Molecular weight
    122.12 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately fast

    Boiling point est.
    197°C

    Flash point

    • 49.42 ˚C est.

  • Synonyms

    • 2-Propen-1-one, 1-(2-furanyl)-
    • 1-(furan-2-yl)prop-2-en-1-one
    • 14123-26-3
    • DTXSID70482915
    • 2-furyl vinylketone
    • furylacrolein
    • SCHEMBL2134381
    • DTXCID70433725
    • DBTNNHQROYDOOG-UHFFFAOYSA-N
    • AKOS014320264
    • EN300-1249130

  • Applications

    2-Propen-1-one, 1-(2-furanyl)- (CAS 14123-26-3) is an α,β-unsaturated ketone bearing a 2-furyl substituent. In industrial contexts it is primarily used as an organic synthesis intermediate and a precursor for furyl-containing fragrance compounds; it is also employed as a building block for pharmaceutical synthesis and can function as a Michael-acceptor in polymer chemistry, enabling crosslinking or copolymerization for coatings and inks.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 680.65
    methanol 1104.58
    isopropanol 448.13
    water 16.51
    ethyl acetate 1056.33
    n-propanol 513.06
    acetone 2051.68
    n-butanol 408.94
    acetonitrile 1725.81
    DMF 2262.21
    toluene 382.23
    isobutanol 376.98
    1,4-dioxane 1654.71
    methyl acetate 1377.3
    THF 1574.08
    2-butanone 1292.02
    n-pentanol 374.11
    sec-butanol 404.02
    n-hexane 91.58
    ethylene glycol 327.61
    NMP 1936.6
    cyclohexane 116.3
    DMSO 2366.24
    n-butyl acetate 575.88
    n-octanol 311.88
    chloroform 1699.27
    n-propyl acetate 887.64
    acetic acid 1004.72
    dichloromethane 2345.45
    cyclohexanone 1353.65
    propylene glycol 219.72
    isopropyl acetate 520.74
    DMAc 1550.47
    2-ethoxyethanol 894.2
    isopentanol 343.78
    n-heptane 64.48
    ethyl formate 798.61
    1,2-dichloroethane 1592.93
    n-hexanol 291.36
    2-methoxyethanol 1154.22
    isobutyl acetate 450.62
    tetrachloromethane 301.27
    n-pentyl acetate 414.55
    transcutol 2092.23
    n-heptanol 186.18
    ethylbenzene 290.01
    MIBK 498.84
    2-propoxyethanol 693.29
    tert-butanol 453.13
    MTBE 562.55
    2-butoxyethanol 418.56
    propionic acid 806.03
    o-xylene 298.65
    formic acid 475.97
    diethyl ether 732.47
    m-xylene 281.6
    p-xylene 421.73
    chlorobenzene 760.01
    dimethyl carbonate 570.33
    n-octane 44.01
    formamide 929.39
    cyclopentanone 1712.05
    2-pentanone 897.5
    anisole 768.99
    cyclopentyl methyl ether 713.82
    gamma-butyrolactone 1962.24
    1-methoxy-2-propanol 735.19
    pyridine 1307.19
    3-pentanone 776.21
    furfural 1628.16
    n-dodecane 48.39
    diethylene glycol 693.22
    diisopropyl ether 224.3
    tert-amyl alcohol 424.07
    acetylacetone 1117.62
    n-hexadecane 55.76
    acetophenone 697.64
    methyl propionate 947.8
    isopentyl acetate 464.47
    trichloroethylene 2486.39
    n-nonanol 253.2
    cyclohexanol 424.53
    benzyl alcohol 505.81
    2-ethylhexanol 217.35
    isooctanol 169.78
    dipropyl ether 335.21
    1,2-dichlorobenzene 699.6
    ethyl lactate 364.59
    propylene carbonate 926.12
    n-methylformamide 1359.91
    2-pentanol 293.86
    n-pentane 75.62
    1-propoxy-2-propanol 443.19
    1-methoxy-2-propyl acetate 510.53
    2-(2-methoxypropoxy) propanol 486.87
    mesitylene 215.65
    ε-caprolactone 1119.92
    p-cymene 156.89
    epichlorohydrin 1931.55
    1,1,1-trichloroethane 1100.31
    2-aminoethanol 382.66
    morpholine-4-carbaldehyde 1753.13
    sulfolane 2173.93
    2,2,4-trimethylpentane 61.87
    2-methyltetrahydrofuran 1152.97
    n-hexyl acetate 675.3
    isooctane 50.27
    2-(2-butoxyethoxy)ethanol 706.91
    sec-butyl acetate 490.9
    tert-butyl acetate 522.53
    decalin 88.76
    glycerin 374.62
    diglyme 1368.7
    acrylic acid 854.29
    isopropyl myristate 265.85
    n-butyric acid 734.39
    acetyl acetate 637.92
    di(2-ethylhexyl) phthalate 198.95
    ethyl propionate 680.42
    nitromethane 2835.12
    1,2-diethoxyethane 728.12
    benzonitrile 801.72
    trioctyl phosphate 171.42
    1-bromopropane 677.45
    gamma-valerolactone 1789.05
    n-decanol 195.34
    triethyl phosphate 239.95
    4-methyl-2-pentanol 191.0
    propionitrile 949.89
    vinylene carbonate 897.55
    1,1,2-trichlorotrifluoroethane 1036.88
    DMS 690.74
    cumene 204.18
    2-octanol 185.78
    2-hexanone 761.68
    octyl acetate 334.3
    limonene 208.96
    1,2-dimethoxyethane 1504.49
    ethyl orthosilicate 218.83
    tributyl phosphate 226.69
    diacetone alcohol 542.87
    N,N-dimethylaniline 462.62
    acrylonitrile 1498.77
    aniline 479.48
    1,3-propanediol 517.14
    bromobenzene 804.3
    dibromomethane 1346.62
    1,1,2,2-tetrachloroethane 1578.67
    2-methyl-cyclohexyl acetate 336.79
    tetrabutyl urea 296.21
    diisobutyl methanol 153.71
    2-phenylethanol 363.6
    styrene 433.86
    dioctyl adipate 356.66
    dimethyl sulfate 912.05
    ethyl butyrate 465.03
    methyl lactate 452.07
    butyl lactate 306.27
    diethyl carbonate 368.08
    propanediol butyl ether 485.31
    triethyl orthoformate 298.73
    p-tert-butyltoluene 145.57
    methyl 4-tert-butylbenzoate 444.86
    morpholine 1469.9
    tert-butylamine 288.64
    n-dodecanol 161.6
    dimethoxymethane 1170.97
    ethylene carbonate 735.8
    cyrene 494.78
    2-ethoxyethyl acetate 567.89
    2-ethylhexyl acetate 381.75
    1,2,4-trichlorobenzene 774.41
    4-methylpyridine 1202.18
    dibutyl ether 411.8
    2,6-dimethyl-4-heptanol 153.71
    DEF 1121.03
    dimethyl isosorbide 730.9
    tetrachloroethylene 1128.03
    eugenol 484.51
    triacetin 635.64
    span 80 352.07
    1,4-butanediol 322.72
    1,1-dichloroethane 1280.59
    2-methyl-1-pentanol 336.89
    methyl formate 1258.86
    2-methyl-1-butanol 344.0
    n-decane 71.43
    butyronitrile 780.84
    3,7-dimethyl-1-octanol 254.01
    1-chlorooctane 256.76
    1-chlorotetradecane 115.01
    n-nonane 72.29
    undecane 57.54
    tert-butylcyclohexane 83.83
    cyclooctane 53.26
    cyclopentanol 532.42
    tetrahydropyran 1059.94
    tert-amyl methyl ether 424.63
    2,5,8-trioxanonane 897.2
    1-hexene 279.28
    2-isopropoxyethanol 597.53
    2,2,2-trifluoroethanol 454.17
    methyl butyrate 952.55

    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