1-(5-Methyl-2-furyl)-2-propanone

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    13678-74-5

    Molecular formula
    C8H10O2

    SMILES
    CC1=CC=C(O1)CC(=O)C

  • Odor profile

    Fruity 75.45%
    Sweet 65.79%
    Caramellic 59.49%
    Nutty 50.9%
    Spicy 49.9%
    Green 46.91%
    Burnt 41.76%
    Herbal 38.85%
    Musty 38.77%
    Roasted 37.68%

    Scent© AI

  • Properties

    XLogP3-AA
    1.0

    pKa est.
    7.1 (neutral)

    Molecular weight
    138.16 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderate

    Boiling point est.
    212°C

    Flash point est.
    66.66 ˚C

  • Synonyms

    • 1-(5-methyl-2-furyl)-2-propanone
    • 1-(5-methylfuran-2-yl)propan-2-one
    • 13678-74-5
    • SCHEMBL4705839
    • 1-(5-Methyl-2-furyl)-propan-2-on
    • EN300-1838098

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 760.45
    methanol 1199.41
    isopropanol 605.62
    water 233.41
    ethyl acetate 409.5
    n-propanol 503.5
    acetone 791.79
    n-butanol 423.17
    acetonitrile 777.51
    DMF 1226.78
    toluene 187.58
    isobutanol 407.49
    1,4-dioxane 1280.23
    methyl acetate 538.08
    THF 1193.35
    2-butanone 394.71
    n-pentanol 251.45
    sec-butanol 424.03
    n-hexane 47.77
    ethylene glycol 619.29
    NMP 1028.98
    cyclohexane 113.03
    DMSO 737.87
    n-butyl acetate 135.37
    n-octanol 233.62
    chloroform 893.34
    n-propyl acetate 180.63
    acetic acid 749.24
    dichloromethane 752.9
    cyclohexanone 535.06
    propylene glycol 600.15
    isopropyl acetate 216.85
    DMAc 1256.25
    2-ethoxyethanol 516.05
    isopentanol 301.71
    n-heptane 40.35
    ethyl formate 332.78
    1,2-dichloroethane 314.0
    n-hexanol 271.9
    2-methoxyethanol 1126.25
    isobutyl acetate 120.26
    tetrachloromethane 148.68
    n-pentyl acetate 125.59
    transcutol 1118.07
    n-heptanol 134.33
    ethylbenzene 105.15
    MIBK 194.65
    2-propoxyethanol 553.55
    tert-butanol 659.18
    MTBE 338.84
    2-butoxyethanol 250.26
    propionic acid 523.06
    o-xylene 168.63
    formic acid 467.13
    diethyl ether 366.82
    m-xylene 147.61
    p-xylene 146.6
    chlorobenzene 208.28
    dimethyl carbonate 314.69
    n-octane 20.01
    formamide 577.12
    cyclopentanone 596.17
    2-pentanone 310.43
    anisole 333.89
    cyclopentyl methyl ether 432.86
    gamma-butyrolactone 758.42
    1-methoxy-2-propanol 793.96
    pyridine 428.98
    3-pentanone 280.37
    furfural 678.41
    n-dodecane 27.34
    diethylene glycol 624.68
    diisopropyl ether 101.07
    tert-amyl alcohol 433.93
    acetylacetone 444.27
    n-hexadecane 29.26
    acetophenone 265.04
    methyl propionate 419.93
    isopentyl acetate 118.45
    trichloroethylene 574.99
    n-nonanol 196.43
    cyclohexanol 474.86
    benzyl alcohol 273.71
    2-ethylhexanol 132.72
    isooctanol 98.33
    dipropyl ether 168.09
    1,2-dichlorobenzene 202.7
    ethyl lactate 190.71
    propylene carbonate 412.05
    n-methylformamide 637.73
    2-pentanol 260.43
    n-pentane 59.37
    1-propoxy-2-propanol 322.82
    1-methoxy-2-propyl acetate 262.96
    2-(2-methoxypropoxy) propanol 333.36
    mesitylene 93.54
    ε-caprolactone 471.3
    p-cymene 73.63
    epichlorohydrin 666.26
    1,1,1-trichloroethane 380.07
    2-aminoethanol 657.62
    morpholine-4-carbaldehyde 1130.46
    sulfolane 693.25
    2,2,4-trimethylpentane 31.77
    2-methyltetrahydrofuran 631.91
    n-hexyl acetate 275.61
    isooctane 20.98
    2-(2-butoxyethoxy)ethanol 457.19
    sec-butyl acetate 125.45
    tert-butyl acetate 220.21
    decalin 43.24
    glycerin 742.38
    diglyme 725.03
    acrylic acid 513.56
    isopropyl myristate 124.47
    n-butyric acid 427.23
    acetyl acetate 315.06
    di(2-ethylhexyl) phthalate 132.65
    ethyl propionate 220.85
    nitromethane 1072.81
    1,2-diethoxyethane 255.92
    benzonitrile 288.57
    trioctyl phosphate 96.36
    1-bromopropane 195.26
    gamma-valerolactone 917.12
    n-decanol 148.25
    triethyl phosphate 100.26
    4-methyl-2-pentanol 140.97
    propionitrile 390.39
    vinylene carbonate 436.9
    1,1,2-trichlorotrifluoroethane 573.7
    DMS 295.33
    cumene 85.21
    2-octanol 106.3
    2-hexanone 178.58
    octyl acetate 170.19
    limonene 110.65
    1,2-dimethoxyethane 780.05
    ethyl orthosilicate 94.06
    tributyl phosphate 109.48
    diacetone alcohol 343.8
    N,N-dimethylaniline 247.49
    acrylonitrile 490.75
    aniline 321.52
    1,3-propanediol 639.03
    bromobenzene 171.0
    dibromomethane 406.54
    1,1,2,2-tetrachloroethane 505.48
    2-methyl-cyclohexyl acetate 137.3
    tetrabutyl urea 165.86
    diisobutyl methanol 80.69
    2-phenylethanol 226.24
    styrene 129.95
    dioctyl adipate 186.43
    dimethyl sulfate 436.12
    ethyl butyrate 153.56
    methyl lactate 365.14
    butyl lactate 143.58
    diethyl carbonate 133.21
    propanediol butyl ether 351.08
    triethyl orthoformate 120.11
    p-tert-butyltoluene 72.85
    methyl 4-tert-butylbenzoate 269.34
    morpholine 1205.87
    tert-butylamine 389.4
    n-dodecanol 120.94
    dimethoxymethane 785.56
    ethylene carbonate 355.01
    cyrene 301.95
    2-ethoxyethyl acetate 210.48
    2-ethylhexyl acetate 93.58
    1,2,4-trichlorobenzene 256.57
    4-methylpyridine 464.04
    dibutyl ether 168.08
    2,6-dimethyl-4-heptanol 80.69
    DEF 487.79
    dimethyl isosorbide 423.97
    tetrachloroethylene 326.03
    eugenol 252.3
    triacetin 336.48
    span 80 306.7
    1,4-butanediol 303.13
    1,1-dichloroethane 404.07
    2-methyl-1-pentanol 193.0
    methyl formate 584.39
    2-methyl-1-butanol 311.05
    n-decane 39.17
    butyronitrile 338.67
    3,7-dimethyl-1-octanol 177.47
    1-chlorooctane 115.23
    1-chlorotetradecane 62.05
    n-nonane 37.33
    undecane 31.77
    tert-butylcyclohexane 40.06
    cyclooctane 34.51
    cyclopentanol 494.48
    tetrahydropyran 720.07
    tert-amyl methyl ether 262.77
    2,5,8-trioxanonane 577.87
    1-hexene 110.3
    2-isopropoxyethanol 320.27
    2,2,2-trifluoroethanol 367.32
    methyl butyrate 271.39

    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
Chicory root, roasted 1a 68650-43-1 Cichorium intybus L., fam. Asteraceae (Compositae) 0.03%
Chicory root, roasted 1b 68650-43-1 Cichorium intybus L., fam. Asteraceae (Compositae) 0.02%