3-Furylmethyl acetate

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  • Identifiers

    CAS number
    30614-67-6

    Molecular formula
    C7H8O3

    SMILES
    CC(=O)OCC1=COC=C1

    Safety labels

  • Odor profile

    Fragrance
    Fruity 93.51%
    Sweet 74.31%
    Floral 61.53%
    Cherry 44.02%
    Berry 39.48%
    Ethereal 37.94%
    Tropical 34.05%
    Anisic 33.96%
    Banana 33.78%
    Winey 33.23%

     

    Flavor
    Sweet 89.01%
    Fruity 88.1%
    Floral 46.09%
    Banana 43.34%
    Bitter 42.7%
    Balsam 41.17%
    Cherry 35.94%
    Plum 35.9%
    Grape 33.18%
    Berry 32.59%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    0.7

    pKa est.
    6.01 (neutral)

    Molecular weight
    140.14 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately fast

    Boiling point est.
    188°C

    Flash point

    • 75.43 ˚C est.

  • Synonyms

    • 3-Furylmethyl acetate
    • 30614-67-6
    • (furan-3-yl)methyl acetate
    • SCHEMBL4022806
    • SCHEMBL11565865
    • SCHEMBL15142478
    • DTXSID40340694
    • QJHHMZOFNNPSHQ-UHFFFAOYSA-N
    • AKOS024319712
    • InChI=1/C7H8O3/c1-6(8)10-5-7-2-3-9-4-7/h2-4H,5H2,1H
    • 30614-67-6

  • Applications

    3-Furylmethyl acetate (CAS 30614-67-6) is primarily used as an intermediate in fragrance and flavor chemistry, supplying furyl-substituted odorants and aroma precursors; it may also function as a solvent or processing aid in coatings, inks, and related industrial formulations; it can serve as a precursor for the synthesis of furyl-containing polymers and resin modifiers within the plastics and materials sector; it is occasionally evaluated for use as a fragrance component in cosmetics and personal care formulations; in general, it is an intermediate and specialty solvent used in industrial manufacturing, with usage governed by formulation limits and local regulations.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 630.33
    methanol 1135.38
    isopropanol 492.09
    water 297.37
    ethyl acetate 191.0
    n-propanol 371.25
    acetone 584.84
    n-butanol 282.99
    acetonitrile 525.35
    DMF 1487.83
    toluene 95.67
    isobutanol 300.11
    1,4-dioxane 652.98
    methyl acetate 350.15
    THF 515.36
    2-butanone 334.89
    n-pentanol 179.03
    sec-butanol 326.43
    n-hexane 11.53
    ethylene glycol 418.93
    NMP 857.08
    cyclohexane 25.3
    DMSO 979.95
    n-butyl acetate 52.26
    n-octanol 96.74
    chloroform 405.22
    n-propyl acetate 92.8
    acetic acid 594.77
    dichloromethane 526.46
    cyclohexanone 332.05
    propylene glycol 410.44
    isopropyl acetate 97.67
    DMAc 1676.37
    2-ethoxyethanol 390.49
    isopentanol 208.04
    n-heptane 12.35
    ethyl formate 260.07
    1,2-dichloroethane 223.58
    n-hexanol 91.78
    2-methoxyethanol 764.51
    isobutyl acetate 60.4
    tetrachloromethane 53.19
    n-pentyl acetate 51.55
    transcutol 445.44
    n-heptanol 70.3
    ethylbenzene 60.36
    MIBK 112.25
    2-propoxyethanol 214.73
    tert-butanol 512.53
    MTBE 215.75
    2-butoxyethanol 141.84
    propionic acid 362.12
    o-xylene 111.73
    formic acid 548.24
    diethyl ether 152.03
    m-xylene 76.62
    p-xylene 100.34
    chlorobenzene 109.29
    dimethyl carbonate 208.11
    n-octane 6.59
    formamide 805.19
    cyclopentanone 392.59
    2-pentanone 186.01
    anisole 199.16
    cyclopentyl methyl ether 187.46
    gamma-butyrolactone 466.9
    1-methoxy-2-propanol 480.79
    pyridine 371.27
    3-pentanone 164.66
    furfural 493.84
    n-dodecane 9.11
    diethylene glycol 270.55
    diisopropyl ether 40.72
    tert-amyl alcohol 374.89
    acetylacetone 226.42
    n-hexadecane 9.62
    acetophenone 188.92
    methyl propionate 255.77
    isopentyl acetate 54.77
    trichloroethylene 436.22
    n-nonanol 84.33
    cyclohexanol 240.35
    benzyl alcohol 203.77
    2-ethylhexanol 61.55
    isooctanol 60.16
    dipropyl ether 64.04
    1,2-dichlorobenzene 112.61
    ethyl lactate 109.15
    propylene carbonate 225.02
    n-methylformamide 754.1
    2-pentanol 158.49
    n-pentane 15.1
    1-propoxy-2-propanol 138.53
    1-methoxy-2-propyl acetate 99.0
    2-(2-methoxypropoxy) propanol 186.82
    mesitylene 50.29
    ε-caprolactone 245.85
    p-cymene 39.43
    epichlorohydrin 460.53
    1,1,1-trichloroethane 187.97
    2-aminoethanol 518.18
    morpholine-4-carbaldehyde 813.16
    sulfolane 504.02
    2,2,4-trimethylpentane 14.39
    2-methyltetrahydrofuran 311.03
    n-hexyl acetate 92.36
    isooctane 7.7
    2-(2-butoxyethoxy)ethanol 202.99
    sec-butyl acetate 61.71
    tert-butyl acetate 100.76
    decalin 15.46
    glycerin 497.48
    diglyme 393.6
    acrylic acid 389.05
    isopropyl myristate 46.35
    n-butyric acid 256.68
    acetyl acetate 125.42
    di(2-ethylhexyl) phthalate 64.5
    ethyl propionate 109.19
    nitromethane 953.33
    1,2-diethoxyethane 100.78
    benzonitrile 186.39
    trioctyl phosphate 44.0
    1-bromopropane 114.56
    gamma-valerolactone 566.25
    n-decanol 65.65
    triethyl phosphate 55.48
    4-methyl-2-pentanol 87.98
    propionitrile 279.5
    vinylene carbonate 256.27
    1,1,2-trichlorotrifluoroethane 415.71
    DMS 112.02
    cumene 52.87
    2-octanol 50.92
    2-hexanone 107.82
    octyl acetate 63.14
    limonene 55.05
    1,2-dimethoxyethane 539.92
    ethyl orthosilicate 52.66
    tributyl phosphate 48.14
    diacetone alcohol 194.7
    N,N-dimethylaniline 191.32
    acrylonitrile 417.29
    aniline 226.84
    1,3-propanediol 435.05
    bromobenzene 88.83
    dibromomethane 237.67
    1,1,2,2-tetrachloroethane 322.07
    2-methyl-cyclohexyl acetate 70.83
    tetrabutyl urea 84.5
    diisobutyl methanol 40.65
    2-phenylethanol 111.5
    styrene 71.68
    dioctyl adipate 78.66
    dimethyl sulfate 335.86
    ethyl butyrate 69.56
    methyl lactate 215.68
    butyl lactate 69.87
    diethyl carbonate 62.01
    propanediol butyl ether 167.99
    triethyl orthoformate 59.82
    p-tert-butyltoluene 37.86
    methyl 4-tert-butylbenzoate 152.04
    morpholine 695.76
    tert-butylamine 279.04
    n-dodecanol 53.27
    dimethoxymethane 528.21
    ethylene carbonate 197.48
    cyrene 219.62
    2-ethoxyethyl acetate 86.2
    2-ethylhexyl acetate 41.72
    1,2,4-trichlorobenzene 148.14
    4-methylpyridine 367.35
    dibutyl ether 62.49
    2,6-dimethyl-4-heptanol 40.65
    DEF 393.07
    dimethyl isosorbide 216.71
    tetrachloroethylene 193.26
    eugenol 154.21
    triacetin 140.78
    span 80 138.88
    1,4-butanediol 224.87
    1,1-dichloroethane 263.25
    2-methyl-1-pentanol 147.64
    methyl formate 534.52
    2-methyl-1-butanol 230.8
    n-decane 12.49
    butyronitrile 226.68
    3,7-dimethyl-1-octanol 85.57
    1-chlorooctane 39.99
    1-chlorotetradecane 21.92
    n-nonane 10.96
    undecane 10.31
    tert-butylcyclohexane 15.57
    cyclooctane 8.68
    cyclopentanol 304.38
    tetrahydropyran 305.16
    tert-amyl methyl ether 164.61
    2,5,8-trioxanonane 315.18
    1-hexene 44.46
    2-isopropoxyethanol 225.21
    2,2,2-trifluoroethanol 311.18
    methyl butyrate 158.46

    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