6,12-Epoxy-elema-1,3-diene

  • Identifiers

    Molecular formula
    C15H24O

    SMILES
    C[C@@H]1CO[C@H]2[C@H]1CC[C@@]([C@@H]2C(=C)C)(C)C=C

  • Odor profile

    Fragrance
    Woody 62.22%
    Herbal 59.07%
    Green 51.68%
    Fruity 51.63%
    Fresh 50.86%
    Citrus 49.8%
    Spicy 48.88%
    Sweet 41.33%
    Mint 39.81%
    Floral 38.83%

     

    Flavor
    Herbal 55.08%
    Fresh 44.81%
    Minty 44.27%
    Herb 43.62%
    Woody 43.35%
    Spice 42.83%
    Green 39.35%
    Wood 35.44%
    Mint 32.54%
    Spicy 24.73%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    4.6

    pKa est.
    7.87 (neutral)

    Molecular weight
    220.35 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    270°C

    Flash point

    • 99.62 ˚C est.

  • Synonyms

    • 6,12-Epoxy-elema-1,3-diene
    • WHGDEUFMJMWQGK-QKGCVVFFSA-N
  • Applications

    6,12-Epoxy-elema-1,3-diene is primarily used as a monomer or intermediate for epoxy resin systems and specialty polymers; it functions as a crosslinking agent and reactive diluent in coatings, inks, and adhesives, helping to improve curing behavior and the mechanical properties of materials; it is also used as an intermediate in the synthesis of industrial plastics and functional materials for electronic applications and UV-curable systems.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 569.33
    methanol 501.48
    isopropanol 773.46
    water 2.96
    ethyl acetate 518.35
    n-propanol 604.05
    acetone 495.02
    n-butanol 670.86
    acetonitrile 552.64
    DMF 445.86
    toluene 749.78
    isobutanol 574.74
    1,4-dioxane 1152.48
    methyl acetate 443.5
    THF 1529.08
    2-butanone 516.79
    n-pentanol 352.51
    sec-butanol 576.71
    n-hexane 89.59
    ethylene glycol 110.28
    NMP 400.6
    cyclohexane 312.91
    DMSO 277.71
    n-butyl acetate 515.79
    n-octanol 371.31
    chloroform 1942.95
    n-propyl acetate 300.46
    acetic acid 342.17
    dichloromethane 1323.49
    cyclohexanone 832.95
    propylene glycol 187.66
    isopropyl acetate 440.49
    DMAc 357.58
    2-ethoxyethanol 365.25
    isopentanol 616.69
    n-heptane 123.62
    ethyl formate 387.11
    1,2-dichloroethane 692.8
    n-hexanol 672.84
    2-methoxyethanol 611.17
    isobutyl acetate 277.83
    tetrachloromethane 429.64
    n-pentyl acetate 379.46
    transcutol 1193.19
    n-heptanol 347.86
    ethylbenzene 311.99
    MIBK 390.3
    2-propoxyethanol 664.68
    tert-butanol 744.38
    MTBE 605.61
    2-butoxyethanol 447.65
    propionic acid 324.64
    o-xylene 383.53
    formic acid 98.76
    diethyl ether 591.54
    m-xylene 499.49
    p-xylene 375.52
    chlorobenzene 641.91
    dimethyl carbonate 190.32
    n-octane 57.58
    formamide 135.74
    cyclopentanone 789.36
    2-pentanone 459.65
    anisole 410.74
    cyclopentyl methyl ether 688.71
    gamma-butyrolactone 748.54
    1-methoxy-2-propanol 560.4
    pyridine 911.3
    3-pentanone 340.5
    furfural 617.57
    n-dodecane 55.84
    diethylene glycol 427.43
    diisopropyl ether 255.63
    tert-amyl alcohol 499.72
    acetylacetone 454.75
    n-hexadecane 63.13
    acetophenone 353.25
    methyl propionate 352.1
    isopentyl acetate 557.54
    trichloroethylene 1151.79
    n-nonanol 309.32
    cyclohexanol 666.98
    benzyl alcohol 366.31
    2-ethylhexanol 388.62
    isooctanol 306.71
    dipropyl ether 367.25
    1,2-dichlorobenzene 540.84
    ethyl lactate 187.16
    propylene carbonate 536.94
    n-methylformamide 260.14
    2-pentanol 495.27
    n-pentane 155.95
    1-propoxy-2-propanol 537.08
    1-methoxy-2-propyl acetate 475.65
    2-(2-methoxypropoxy) propanol 386.62
    mesitylene 342.88
    ε-caprolactone 666.92
    p-cymene 266.57
    epichlorohydrin 905.3
    1,1,1-trichloroethane 827.34
    2-aminoethanol 249.54
    morpholine-4-carbaldehyde 602.27
    sulfolane 534.86
    2,2,4-trimethylpentane 80.54
    2-methyltetrahydrofuran 998.32
    n-hexyl acetate 544.26
    isooctane 86.95
    2-(2-butoxyethoxy)ethanol 525.15
    sec-butyl acetate 265.0
    tert-butyl acetate 416.69
    decalin 108.56
    glycerin 226.24
    diglyme 848.61
    acrylic acid 249.37
    isopropyl myristate 241.59
    n-butyric acid 570.79
    acetyl acetate 345.98
    di(2-ethylhexyl) phthalate 228.31
    ethyl propionate 274.58
    nitromethane 421.97
    1,2-diethoxyethane 479.25
    benzonitrile 589.57
    trioctyl phosphate 182.61
    1-bromopropane 629.95
    gamma-valerolactone 852.15
    n-decanol 231.15
    triethyl phosphate 168.77
    4-methyl-2-pentanol 344.19
    propionitrile 563.73
    vinylene carbonate 526.13
    1,1,2-trichlorotrifluoroethane 472.4
    DMS 307.54
    cumene 232.78
    2-octanol 263.9
    2-hexanone 290.88
    octyl acetate 289.09
    limonene 325.87
    1,2-dimethoxyethane 602.7
    ethyl orthosilicate 179.14
    tributyl phosphate 196.24
    diacetone alcohol 386.74
    N,N-dimethylaniline 274.87
    acrylonitrile 517.64
    aniline 562.89
    1,3-propanediol 407.53
    bromobenzene 740.9
    dibromomethane 995.85
    1,1,2,2-tetrachloroethane 958.15
    2-methyl-cyclohexyl acetate 313.25
    tetrabutyl urea 219.12
    diisobutyl methanol 249.09
    2-phenylethanol 473.39
    styrene 338.42
    dioctyl adipate 276.82
    dimethyl sulfate 200.77
    ethyl butyrate 336.25
    methyl lactate 215.77
    butyl lactate 290.17
    diethyl carbonate 240.38
    propanediol butyl ether 403.89
    triethyl orthoformate 275.63
    p-tert-butyltoluene 254.41
    methyl 4-tert-butylbenzoate 367.72
    morpholine 1074.71
    tert-butylamine 564.1
    n-dodecanol 180.42
    dimethoxymethane 510.83
    ethylene carbonate 491.45
    cyrene 300.68
    2-ethoxyethyl acetate 420.1
    2-ethylhexyl acetate 429.92
    1,2,4-trichlorobenzene 575.04
    4-methylpyridine 820.43
    dibutyl ether 347.77
    2,6-dimethyl-4-heptanol 249.09
    DEF 394.86
    dimethyl isosorbide 570.42
    tetrachloroethylene 656.61
    eugenol 342.09
    triacetin 401.69
    span 80 378.99
    1,4-butanediol 179.44
    1,1-dichloroethane 880.33
    2-methyl-1-pentanol 357.11
    methyl formate 246.92
    2-methyl-1-butanol 532.74
    n-decane 88.0
    butyronitrile 659.56
    3,7-dimethyl-1-octanol 358.32
    1-chlorooctane 273.13
    1-chlorotetradecane 114.78
    n-nonane 86.23
    undecane 67.99
    tert-butylcyclohexane 96.88
    cyclooctane 122.5
    cyclopentanol 619.38
    tetrahydropyran 1219.76
    tert-amyl methyl ether 382.4
    2,5,8-trioxanonane 548.16
    1-hexene 228.52
    2-isopropoxyethanol 301.25
    2,2,2-trifluoroethanol 163.89
    methyl butyrate 331.48

    Scent© AI

1 of 4
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
Name CAS Botanical Proportion
Vetiver (Haiti) 84238-29-9 Vetiveria zizanioides Stapf, fam. Poaceae (Gramineae) 0.4%