2(5H)-Furanone, 5-methyl-3-[10-[3-(3-octadecenyl)oxiranyl]decyl]-

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  • Identifiers

    CAS number
    152340-40-4

    Molecular formula
    C35H62O3

    SMILES
    CCCCCCCCCCCCCCC=CCCC1C(O1)CCCCCCCCCCC2=CC(OC2=O)C

    Safety labels

  • Odor profile

    Fragrance
    Fatty 57.73%
    Waxy 53.44%
    Oily 45.12%
    Fruity 26.82%
    Odorless 24.49%
    Milky 22.62%
    Meaty 21.68%
    Creamy 21.41%
    Savory 21.38%
    Dairy 21.16%

     

    Flavor
    Waxy 34.14%
    Fatty 26.92%
    Bland 26.84%
    Faint 25.18%
    Mild 25.04%
    Slightly waxy 21.92%
    Oily 21.32%
    Delicate 20.73%
    Diterpene 20.3%
    Low 19.88%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    13.8

    pKa est.
    7.64 (neutral)

    Molecular weight
    530.9 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    659°C

    Flash point

    • 229.97 ˚C est.

  • Synonyms

    • DTXSID101169157
    • 2(5H)-Furanone, 5-methyl-3-[10-[3-(3-octadecenyl)oxiranyl]decyl]-
    • 5-Methyl-3-{10-[3-(octadec-3-en-1-yl)oxiran-2-yl]decyl}furan-2(5H)-one
    • 152340-40-4
    • 152340-40-4

  • Applications

    For the chemical 2(5H)-Furanone, 5-methyl-3-[10-[3-(3-octadecenyl)oxiranyl]decyl]- (CAS 152340-40-4), real-world applications include: fragrance ingredient and fixative in perfumery; fragrance component in cosmetics and personal care products; reactive intermediate or crosslinking modifier in polymer systems and coatings/adhesives leveraging the epoxide functionality; a synthetic intermediate in specialty chemical development, including pharmaceutical-related research; and potential formulation additive in certain resin or coating systems to influence performance. Subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 6.06
    methanol 4.56
    isopropanol 5.59
    water 0.02
    ethyl acetate 67.26
    n-propanol 9.29
    acetone 31.34
    n-butanol 11.65
    acetonitrile 11.6
    DMF 26.13
    toluene 36.35
    isobutanol 8.79
    1,4-dioxane 58.73
    methyl acetate 36.53
    THF 155.45
    2-butanone 59.28
    n-pentanol 12.73
    sec-butanol 12.04
    n-hexane 7.47
    ethylene glycol 0.52
    NMP 132.09
    cyclohexane 22.68
    DMSO 33.5
    n-butyl acetate 68.43
    n-octanol 14.89
    chloroform 332.84
    n-propyl acetate 67.37
    acetic acid 18.32
    dichloromethane 341.32
    cyclohexanone 167.83
    propylene glycol 1.51
    isopropyl acetate 65.92
    DMAc 107.25
    2-ethoxyethanol 24.74
    isopentanol 15.33
    n-heptane 7.42
    ethyl formate 21.24
    1,2-dichloroethane 148.86
    n-hexanol 11.11
    2-methoxyethanol 17.63
    isobutyl acetate 50.83
    tetrachloromethane 55.95
    n-pentyl acetate 101.65
    transcutol 135.09
    n-heptanol 15.38
    ethylbenzene 30.36
    MIBK 54.13
    2-propoxyethanol 28.7
    tert-butanol 9.98
    MTBE 37.31
    2-butoxyethanol 44.33
    propionic acid 16.94
    o-xylene 30.9
    formic acid 3.92
    diethyl ether 35.39
    m-xylene 26.47
    p-xylene 38.94
    chlorobenzene 72.92
    dimethyl carbonate 18.9
    n-octane 4.01
    formamide 7.65
    cyclopentanone 153.77
    2-pentanone 61.77
    anisole 56.56
    cyclopentyl methyl ether 90.02
    gamma-butyrolactone 134.61
    1-methoxy-2-propanol 20.38
    pyridine 90.24
    3-pentanone 64.23
    furfural 90.87
    n-dodecane 2.4
    diethylene glycol 8.25
    diisopropyl ether 20.06
    tert-amyl alcohol 18.5
    acetylacetone 85.78
    n-hexadecane 2.97
    acetophenone 73.17
    methyl propionate 45.2
    isopentyl acetate 76.9
    trichloroethylene 290.67
    n-nonanol 18.5
    cyclohexanol 28.38
    benzyl alcohol 24.58
    2-ethylhexanol 17.53
    isooctanol 17.85
    dipropyl ether 44.97
    1,2-dichlorobenzene 91.46
    ethyl lactate 24.03
    propylene carbonate 84.99
    n-methylformamide 11.63
    2-pentanol 11.84
    n-pentane 4.84
    1-propoxy-2-propanol 33.74
    1-methoxy-2-propyl acetate 78.35
    2-(2-methoxypropoxy) propanol 50.64
    mesitylene 18.97
    ε-caprolactone 176.81
    p-cymene 22.87
    epichlorohydrin 186.21
    1,1,1-trichloroethane 187.27
    2-aminoethanol 2.41
    morpholine-4-carbaldehyde 77.86
    sulfolane 182.49
    2,2,4-trimethylpentane 6.28
    2-methyltetrahydrofuran 137.09
    n-hexyl acetate 88.45
    isooctane 3.15
    2-(2-butoxyethoxy)ethanol 57.25
    sec-butyl acetate 69.89
    tert-butyl acetate 83.51
    decalin 12.92
    glycerin 3.0
    diglyme 155.12
    acrylic acid 12.6
    isopropyl myristate 33.1
    n-butyric acid 42.8
    acetyl acetate 57.34
    di(2-ethylhexyl) phthalate 28.86
    ethyl propionate 68.64
    nitromethane 42.76
    1,2-diethoxyethane 82.37
    benzonitrile 33.42
    trioctyl phosphate 18.56
    1-bromopropane 91.06
    gamma-valerolactone 186.96
    n-decanol 11.59
    triethyl phosphate 51.36
    4-methyl-2-pentanol 11.23
    propionitrile 16.02
    vinylene carbonate 60.98
    1,1,2-trichlorotrifluoroethane 111.12
    DMS 45.84
    cumene 22.92
    2-octanol 14.05
    2-hexanone 66.41
    octyl acetate 37.06
    limonene 37.3
    1,2-dimethoxyethane 67.07
    ethyl orthosilicate 53.9
    tributyl phosphate 26.6
    diacetone alcohol 48.21
    N,N-dimethylaniline 40.76
    acrylonitrile 15.38
    aniline 27.79
    1,3-propanediol 5.97
    bromobenzene 98.07
    dibromomethane 179.08
    1,1,2,2-tetrachloroethane 254.59
    2-methyl-cyclohexyl acetate 77.65
    tetrabutyl urea 39.75
    diisobutyl methanol 15.46
    2-phenylethanol 26.23
    styrene 32.21
    dioctyl adipate 56.41
    dimethyl sulfate 44.58
    ethyl butyrate 84.98
    methyl lactate 16.13
    butyl lactate 49.57
    diethyl carbonate 51.7
    propanediol butyl ether 21.4
    triethyl orthoformate 76.3
    p-tert-butyltoluene 19.64
    methyl 4-tert-butylbenzoate 83.65
    morpholine 69.81
    tert-butylamine 8.25
    n-dodecanol 8.04
    dimethoxymethane 30.23
    ethylene carbonate 58.19
    cyrene 60.35
    2-ethoxyethyl acetate 117.55
    2-ethylhexyl acetate 72.54
    1,2,4-trichlorobenzene 117.72
    4-methylpyridine 77.15
    dibutyl ether 49.04
    2,6-dimethyl-4-heptanol 15.46
    DEF 71.03
    dimethyl isosorbide 133.03
    tetrachloroethylene 143.23
    eugenol 53.75
    triacetin 110.73
    span 80 43.79
    1,4-butanediol 3.06
    1,1-dichloroethane 122.62
    2-methyl-1-pentanol 19.5
    methyl formate 10.19
    2-methyl-1-butanol 15.87
    n-decane 5.77
    butyronitrile 20.1
    3,7-dimethyl-1-octanol 19.67
    1-chlorooctane 25.64
    1-chlorotetradecane 8.33
    n-nonane 5.07
    undecane 3.48
    tert-butylcyclohexane 8.4
    cyclooctane 8.14
    cyclopentanol 25.84
    tetrahydropyran 98.43
    tert-amyl methyl ether 45.28
    2,5,8-trioxanonane 88.43
    1-hexene 19.01
    2-isopropoxyethanol 24.88
    2,2,2-trifluoroethanol 13.96
    methyl butyrate 82.68

    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