10,13-Epoxy-11-methyloctadeca-10,12-dienoic acid

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  • Identifiers

    CAS number
    57818-39-0

    Molecular formula
    C19H32O3

    SMILES
    CCCCCC1=CC(=C(O1)CCCCCCCCC(=O)O)C

    Safety labels

  • Odor profile

    Fragrance
    Fatty 67.74%
    Waxy 55.88%
    Oily 40.64%
    Dairy 37.5%
    Creamy 36.29%
    Meaty 35.6%
    Floral 34.99%
    Milky 34.51%
    Roasted 30.24%
    Coconut 30.09%

     

    Flavor
    Fatty 54.12%
    Waxy 41.92%
    Oily 38.66%
    Mild 34.08%
    Creamy 31.56%
    Coconut 31.54%
    Fat 31.02%
    Mushroom 25.45%
    Bland 25.1%
    Musty 24.86%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    6.3

    pKa est.
    7.53 (neutral)

    Molecular weight
    308.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    404°C

    Flash point

    • 204.15 ˚C est.

  • Synonyms

    • 57818-39-0
    • 10,13-Epoxy-11-methyloctadeca-10,12-dienoic acid
    • 9-(3-methyl-5-pentylfuran-2-yl)nonanoic acid
    • Emod F-acid
    • 2-Furannonanoic acid, 3-methyl-5-pentyl-
    • DTXSID10206531
    • RefChem:77390
    • DTXCID40129022
    • 3-Methyl-5-pentyl-2-furannonanoic acid
    • 9-(3-methyl-5-pentyl-2-furyl)nonanoic acid
    • 10,13-epoxy-11-methyl-octadecadienoic acid
    • 9M5
    • F2 Acid
    • starbld0016062
    • MonoMe(9,5)
    • D8FS6VUD44
    • orb2283246
    • SCHEMBL17364249
    • CHEBI:177831
    • HY-N12401
    • LMFA01150005
    • MFCD18974334
    • PD151253
    • DB-322767
    • 9-(3-methyl-5-pentyluran-2-yl)nonanoic acid
    • 9-(3-Methyl-5-pentyl-furan-2-yl)nonanoic acid
    • 9-(3-methyl-5-pentylfuran-2-yl)-nonanoic acid
    • 10,13-Epoxy-11-methyl-10,12-octadecadienoic acid
    • 57818-39-0

  • Applications

    10,13-Epoxy-11-methyloctadeca-10,12-dienoic acid (CAS 57818-39-0) is used primarily as a specialized building block in chemical synthesis for epoxy-functional polymers and resin systems; it can function as a monomer or co-monomer in coatings and adhesive formulations to impart reactive functionality and crosslinking capability; it may serve as an intermediate for functionalized esters or as a starting point for the preparation of specialty cosmetic ingredients after appropriate derivatization; it is also evaluated as a reactive intermediate for plasticizers or stabilizers in polymer formulations; in industrial manufacturing it provides a platform to introduce epoxy and conjugated fatty-acid features into downstream products, subject to formulation constraints and regulatory compliance.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1642.81
    methanol 1764.25
    isopropanol 1205.61
    water 0.09
    ethyl acetate 1191.85
    n-propanol 1200.77
    acetone 1937.29
    n-butanol 1027.51
    acetonitrile 384.56
    DMF 2046.22
    toluene 291.31
    isobutanol 872.36
    1,4-dioxane 1610.75
    methyl acetate 813.64
    THF 2905.3
    2-butanone 1377.15
    n-pentanol 710.38
    sec-butanol 933.65
    n-hexane 47.01
    ethylene glycol 50.38
    NMP 1369.36
    cyclohexane 95.73
    DMSO 1573.91
    n-butyl acetate 901.92
    n-octanol 177.37
    chloroform 1564.53
    n-propyl acetate 1041.34
    acetic acid 446.99
    dichloromethane 1918.2
    cyclohexanone 1880.34
    propylene glycol 173.42
    isopropyl acetate 1008.93
    DMAc 2139.74
    2-ethoxyethanol 1159.16
    isopentanol 940.84
    n-heptane 16.33
    ethyl formate 527.31
    1,2-dichloroethane 1422.46
    n-hexanol 423.54
    2-methoxyethanol 1540.39
    isobutyl acetate 751.29
    tetrachloromethane 188.97
    n-pentyl acetate 667.49
    transcutol 3064.51
    n-heptanol 206.94
    ethylbenzene 176.07
    MIBK 879.66
    2-propoxyethanol 996.1
    tert-butanol 1101.72
    MTBE 1595.61
    2-butoxyethanol 571.64
    propionic acid 459.96
    o-xylene 197.5
    formic acid 105.29
    diethyl ether 1420.46
    m-xylene 204.25
    p-xylene 251.98
    chlorobenzene 456.73
    dimethyl carbonate 235.36
    n-octane 11.37
    formamide 234.12
    cyclopentanone 1738.92
    2-pentanone 1412.31
    anisole 527.07
    cyclopentyl methyl ether 1189.0
    gamma-butyrolactone 1511.14
    1-methoxy-2-propanol 1322.97
    pyridine 926.08
    3-pentanone 746.7
    furfural 920.04
    n-dodecane 10.25
    diethylene glycol 426.83
    diisopropyl ether 309.63
    tert-amyl alcohol 919.99
    acetylacetone 1209.77
    n-hexadecane 12.39
    acetophenone 516.95
    methyl propionate 781.65
    isopentyl acetate 894.47
    trichloroethylene 1793.03
    n-nonanol 172.69
    cyclohexanol 726.41
    benzyl alcohol 409.99
    2-ethylhexanol 248.6
    isooctanol 199.58
    dipropyl ether 400.6
    1,2-dichlorobenzene 444.65
    ethyl lactate 286.97
    propylene carbonate 824.52
    n-methylformamide 688.47
    2-pentanol 627.94
    n-pentane 35.29
    1-propoxy-2-propanol 731.1
    1-methoxy-2-propyl acetate 859.25
    2-(2-methoxypropoxy) propanol 451.55
    mesitylene 130.49
    ε-caprolactone 1449.42
    p-cymene 95.17
    epichlorohydrin 2011.6
    1,1,1-trichloroethane 860.38
    2-aminoethanol 281.53
    morpholine-4-carbaldehyde 1435.45
    sulfolane 1556.15
    2,2,4-trimethylpentane 36.34
    2-methyltetrahydrofuran 2008.71
    n-hexyl acetate 688.12
    isooctane 23.35
    2-(2-butoxyethoxy)ethanol 733.86
    sec-butyl acetate 749.59
    tert-butyl acetate 1052.59
    decalin 51.09
    glycerin 194.96
    diglyme 1573.94
    acrylic acid 233.51
    isopropyl myristate 211.41
    n-butyric acid 1103.25
    acetyl acetate 501.98
    di(2-ethylhexyl) phthalate 198.77
    ethyl propionate 718.07
    nitromethane 918.31
    1,2-diethoxyethane 1199.37
    benzonitrile 388.42
    trioctyl phosphate 130.19
    1-bromopropane 839.23
    gamma-valerolactone 2410.27
    n-decanol 115.67
    triethyl phosphate 205.14
    4-methyl-2-pentanol 344.69
    propionitrile 428.88
    vinylene carbonate 598.14
    1,1,2-trichlorotrifluoroethane 871.29
    DMS 448.02
    cumene 127.7
    2-octanol 158.34
    2-hexanone 969.86
    octyl acetate 272.52
    limonene 174.55
    1,2-dimethoxyethane 2130.01
    ethyl orthosilicate 231.95
    tributyl phosphate 190.22
    diacetone alcohol 877.66
    N,N-dimethylaniline 316.01
    acrylonitrile 374.09
    aniline 410.93
    1,3-propanediol 599.01
    bromobenzene 485.87
    dibromomethane 1127.83
    1,1,2,2-tetrachloroethane 1618.99
    2-methyl-cyclohexyl acetate 447.72
    tetrabutyl urea 260.22
    diisobutyl methanol 145.78
    2-phenylethanol 342.5
    styrene 243.78
    dioctyl adipate 328.65
    dimethyl sulfate 395.46
    ethyl butyrate 578.88
    methyl lactate 282.51
    butyl lactate 413.21
    diethyl carbonate 298.78
    propanediol butyl ether 434.08
    triethyl orthoformate 376.17
    p-tert-butyltoluene 91.97
    methyl 4-tert-butylbenzoate 407.44
    morpholine 2492.25
    tert-butylamine 627.79
    n-dodecanol 82.27
    dimethoxymethane 1505.65
    ethylene carbonate 638.48
    cyrene 426.62
    2-ethoxyethyl acetate 887.72
    2-ethylhexyl acetate 642.7
    1,2,4-trichlorobenzene 507.76
    4-methylpyridine 984.34
    dibutyl ether 395.57
    2,6-dimethyl-4-heptanol 145.78
    DEF 1442.64
    dimethyl isosorbide 755.02
    tetrachloroethylene 972.39
    eugenol 378.64
    triacetin 574.28
    span 80 368.49
    1,4-butanediol 227.05
    1,1-dichloroethane 1184.97
    2-methyl-1-pentanol 653.16
    methyl formate 332.34
    2-methyl-1-butanol 847.43
    n-decane 20.14
    butyronitrile 683.51
    3,7-dimethyl-1-octanol 213.45
    1-chlorooctane 139.96
    1-chlorotetradecane 46.7
    n-nonane 17.37
    undecane 13.67
    tert-butylcyclohexane 42.83
    cyclooctane 19.05
    cyclopentanol 745.37
    tetrahydropyran 2266.62
    tert-amyl methyl ether 896.42
    2,5,8-trioxanonane 834.41
    1-hexene 328.48
    2-isopropoxyethanol 860.75
    2,2,2-trifluoroethanol 142.53
    methyl butyrate 1125.47

    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