7,11;8,12-Diepoxy-eremophil-9-ene (epimer A)

  • Identifiers

    Molecular formula
    C15H22O2

    SMILES
    C[C@H]1CCCC2=CC3C4(C[C@]12C)C(O4)(CO3)C

  • Odor profile

    Fragrance
    Woody 59.94%
    Fruity 47.36%
    Amber 39.01%
    Musk 36.06%
    Dry 31.65%
    Floral 31.29%
    Spicy 29.78%
    Cedar 28.76%
    Fresh 27.37%
    Powdery 27.34%

     

    Flavor
    Earthy 43.72%
    Bitter 32.43%
    Earth 31.12%
    Woody 30.85%
    Spicy 26.37%
    Camphor 24.55%
    Musty 24.45%
    Soil 23.9%
    Patchouli 23.71%
    Beet 23.4%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    2.5

    pKa est.
    7.55 (neutral)

    Molecular weight
    234.33 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very slow

    Boiling point est.
    320°C

    Flash point

    • 116.65 ˚C est.

  • Synonyms

    • LHTGLYLMFOPXAB-ZENOWJCDSA-N
    • 7,11;8,12-Diepoxy-eremophil-9-ene (epimer A)
  • Applications

    7,11;8,12-Diepoxy-eremophil-9-ene (epimer A) is a diepoxide terpenoid that is explored as a synthetic intermediate and building block in organic synthesis. In industrial manufacturing, it may serve as an epoxy-containing crosslinking agent or precursor for specialty epoxy resins used in coatings, adhesives, and electronic encapsulation. It can be employed as a starting material to access functional sesquiterpene derivatives for pharmaceutical and agrochemical research, or as a monomer for functional polymers and plastics. Additionally, formulation scientists may evaluate it as a fragrance/aroma intermediate in perfumery, subject to formulation constraints.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 43.42
    methanol 45.25
    isopropanol 41.45
    water 0.89
    ethyl acetate 84.41
    n-propanol 49.7
    acetone 89.03
    n-butanol 49.98
    acetonitrile 70.07
    DMF 85.11
    toluene 128.79
    isobutanol 41.12
    1,4-dioxane 175.8
    methyl acetate 82.97
    THF 187.93
    2-butanone 91.92
    n-pentanol 37.11
    sec-butanol 30.76
    n-hexane 3.0
    ethylene glycol 18.56
    NMP 69.74
    cyclohexane 13.83
    DMSO 64.39
    n-butyl acetate 70.98
    n-octanol 32.06
    chloroform 287.47
    n-propyl acetate 59.11
    acetic acid 48.53
    dichloromethane 205.64
    cyclohexanone 134.4
    propylene glycol 18.42
    isopropyl acetate 73.83
    DMAc 97.32
    2-ethoxyethanol 71.54
    isopentanol 51.44
    n-heptane 5.16
    ethyl formate 59.87
    1,2-dichloroethane 110.87
    n-hexanol 52.7
    2-methoxyethanol 100.85
    isobutyl acetate 59.27
    tetrachloromethane 47.75
    n-pentyl acetate 58.86
    transcutol 202.93
    n-heptanol 37.36
    ethylbenzene 59.29
    MIBK 75.26
    2-propoxyethanol 110.43
    tert-butanol 46.19
    MTBE 43.68
    2-butoxyethanol 79.32
    propionic acid 42.7
    o-xylene 77.47
    formic acid 23.65
    diethyl ether 52.55
    m-xylene 86.91
    p-xylene 88.97
    chlorobenzene 115.14
    dimethyl carbonate 53.39
    n-octane 3.39
    formamide 45.12
    cyclopentanone 138.7
    2-pentanone 77.87
    anisole 103.37
    cyclopentyl methyl ether 79.03
    gamma-butyrolactone 120.79
    1-methoxy-2-propanol 79.34
    pyridine 175.67
    3-pentanone 71.2
    furfural 137.85
    n-dodecane 4.41
    diethylene glycol 96.45
    diisopropyl ether 27.56
    tert-amyl alcohol 29.73
    acetylacetone 114.61
    n-hexadecane 5.37
    acetophenone 97.86
    methyl propionate 72.45
    isopentyl acetate 83.1
    trichloroethylene 218.65
    n-nonanol 35.17
    cyclohexanol 50.99
    benzyl alcohol 82.53
    2-ethylhexanol 38.51
    isooctanol 35.06
    dipropyl ether 38.23
    1,2-dichlorobenzene 106.4
    ethyl lactate 41.76
    propylene carbonate 80.68
    n-methylformamide 51.18
    2-pentanol 31.6
    n-pentane 4.94
    1-propoxy-2-propanol 75.24
    1-methoxy-2-propyl acetate 104.16
    2-(2-methoxypropoxy) propanol 82.89
    mesitylene 55.88
    ε-caprolactone 107.61
    p-cymene 40.71
    epichlorohydrin 151.7
    1,1,1-trichloroethane 114.74
    2-aminoethanol 31.66
    morpholine-4-carbaldehyde 126.02
    sulfolane 91.65
    2,2,4-trimethylpentane 4.27
    2-methyltetrahydrofuran 98.34
    n-hexyl acetate 70.77
    isooctane 4.85
    2-(2-butoxyethoxy)ethanol 99.3
    sec-butyl acetate 55.89
    tert-butyl acetate 72.26
    decalin 11.0
    glycerin 29.87
    diglyme 181.81
    acrylic acid 43.44
    isopropyl myristate 40.53
    n-butyric acid 66.0
    acetyl acetate 83.59
    di(2-ethylhexyl) phthalate 46.56
    ethyl propionate 61.91
    nitromethane 96.24
    1,2-diethoxyethane 83.23
    benzonitrile 113.72
    trioctyl phosphate 32.09
    1-bromopropane 60.12
    gamma-valerolactone 183.32
    n-decanol 28.22
    triethyl phosphate 41.38
    4-methyl-2-pentanol 33.23
    propionitrile 76.12
    vinylene carbonate 101.36
    1,1,2-trichlorotrifluoroethane 96.55
    DMS 81.38
    cumene 43.7
    2-octanol 25.01
    2-hexanone 61.44
    octyl acetate 44.97
    limonene 40.29
    1,2-dimethoxyethane 133.47
    ethyl orthosilicate 41.51
    tributyl phosphate 35.41
    diacetone alcohol 72.57
    N,N-dimethylaniline 65.82
    acrylonitrile 89.48
    aniline 102.64
    1,3-propanediol 53.8
    bromobenzene 135.86
    dibromomethane 127.98
    1,1,2,2-tetrachloroethane 159.51
    2-methyl-cyclohexyl acetate 70.16
    tetrabutyl urea 45.65
    diisobutyl methanol 30.92
    2-phenylethanol 95.19
    styrene 67.98
    dioctyl adipate 51.35
    dimethyl sulfate 57.09
    ethyl butyrate 61.33
    methyl lactate 43.98
    butyl lactate 51.43
    diethyl carbonate 53.31
    propanediol butyl ether 57.3
    triethyl orthoformate 53.61
    p-tert-butyltoluene 40.03
    methyl 4-tert-butylbenzoate 80.33
    morpholine 143.61
    tert-butylamine 31.97
    n-dodecanol 22.96
    dimethoxymethane 108.02
    ethylene carbonate 86.98
    cyrene 77.72
    2-ethoxyethyl acetate 94.59
    2-ethylhexyl acetate 68.06
    1,2,4-trichlorobenzene 118.92
    4-methylpyridine 158.1
    dibutyl ether 34.51
    2,6-dimethyl-4-heptanol 30.92
    DEF 67.15
    dimethyl isosorbide 123.81
    tetrachloroethylene 110.27
    eugenol 82.22
    triacetin 88.52
    span 80 62.57
    1,4-butanediol 24.72
    1,1-dichloroethane 104.78
    2-methyl-1-pentanol 38.08
    methyl formate 47.32
    2-methyl-1-butanol 39.64
    n-decane 6.54
    butyronitrile 69.49
    3,7-dimethyl-1-octanol 38.85
    1-chlorooctane 23.29
    1-chlorotetradecane 13.69
    n-nonane 4.92
    undecane 5.21
    tert-butylcyclohexane 8.41
    cyclooctane 6.96
    cyclopentanol 49.78
    tetrahydropyran 118.51
    tert-amyl methyl ether 33.14
    2,5,8-trioxanonane 131.28
    1-hexene 14.54
    2-isopropoxyethanol 58.36
    2,2,2-trifluoroethanol 32.19
    methyl butyrate 67.28

    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) 0.35%