Trichodiol A

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  • Identifiers

    CAS number
    28381-39-7

    Molecular formula
    C15H24O3

    SMILES
    CC1(CCC(C=C1)(C)O)C2(CCC3C2(O3)CO)C

    Safety labels

  • Odor profile

    Fragrance
    Woody 60.71%
    Amber 35.72%
    Balsamic 34.24%
    Sweet 32.57%
    Floral 31.82%
    Fruity 31.03%
    Dry 29.85%
    Fresh 28.3%
    Musk 28.17%
    Mint 27.72%

     

    Flavor
    Minty 38.42%
    Herbal 36.37%
    Earthy 34.67%
    Bitter 33.9%
    Woody 29.72%
    Camphor 27.97%
    Pine 27.9%
    Green 27.55%
    Earth 26.59%
    Fresh 25.17%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    1.5

    pKa est.
    6.97 (neutral)

    Molecular weight
    252.35 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    415°C

    Flash point

    • 142.33 ˚C est.

  • Synonyms

    • Trichodiol A
    • 28381-39-7
    • 6-Oxabicyclo(3.1.0)hexane-1-methanol, 2-(4-hydroxy-1,4-dimethyl-2-cyclohexen-1-yl)-2-methyl-
    • DTXSID30951051
    • 4-[1-(hydroxymethyl)-2-methyl-6-oxabicyclo[3.1.0]hexan-2-yl]-1,4-dimethylcyclohex-2-en-1-ol
    • 28381-39-7

  • Applications

    Trichodiol A (CAS 28381-39-7) is a diol-type natural product that is typically considered as an intermediate or building block in chemical synthesis. In industry, potential applications include use as a precursor for specialty polymers and polyurethanes, as a scaffold or starting material in pharmaceutical or agrochemical research, and as a fragrance/cosmetic-related ingredient precursor. It may also serve as a component in coatings or inks (as a polyol derivative) and, in some formulations, as a processing aid or solvent, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 183.91
    methanol 306.48
    isopropanol 148.95
    water 2.93
    ethyl acetate 123.62
    n-propanol 137.09
    acetone 199.5
    n-butanol 108.37
    acetonitrile 145.86
    DMF 351.57
    toluene 52.33
    isobutanol 83.71
    1,4-dioxane 278.86
    methyl acetate 118.7
    THF 496.28
    2-butanone 124.48
    n-pentanol 53.54
    sec-butanol 67.57
    n-hexane 2.37
    ethylene glycol 90.13
    NMP 109.39
    cyclohexane 6.74
    DMSO 270.46
    n-butyl acetate 58.55
    n-octanol 32.09
    chloroform 237.33
    n-propyl acetate 61.86
    acetic acid 108.96
    dichloromethane 165.36
    cyclohexanone 120.87
    propylene glycol 79.78
    isopropyl acetate 94.95
    DMAc 181.89
    2-ethoxyethanol 155.56
    isopentanol 84.38
    n-heptane 3.25
    ethyl formate 72.44
    1,2-dichloroethane 106.49
    n-hexanol 67.83
    2-methoxyethanol 333.52
    isobutyl acetate 51.07
    tetrachloromethane 38.23
    n-pentyl acetate 45.0
    transcutol 282.37
    n-heptanol 40.8
    ethylbenzene 26.18
    MIBK 94.27
    2-propoxyethanol 198.63
    tert-butanol 157.18
    MTBE 95.19
    2-butoxyethanol 98.47
    propionic acid 70.55
    o-xylene 33.4
    formic acid 119.38
    diethyl ether 110.78
    m-xylene 44.33
    p-xylene 34.77
    chlorobenzene 60.64
    dimethyl carbonate 93.53
    n-octane 1.81
    formamide 209.08
    cyclopentanone 190.82
    2-pentanone 115.42
    anisole 82.87
    cyclopentyl methyl ether 106.76
    gamma-butyrolactone 171.33
    1-methoxy-2-propanol 258.28
    pyridine 121.45
    3-pentanone 82.53
    furfural 148.76
    n-dodecane 1.78
    diethylene glycol 224.98
    diisopropyl ether 32.89
    tert-amyl alcohol 73.1
    acetylacetone 163.6
    n-hexadecane 2.12
    acetophenone 71.24
    methyl propionate 108.49
    isopentyl acetate 62.87
    trichloroethylene 186.88
    n-nonanol 32.1
    cyclohexanol 62.1
    benzyl alcohol 66.81
    2-ethylhexanol 33.5
    isooctanol 34.29
    dipropyl ether 38.65
    1,2-dichlorobenzene 58.73
    ethyl lactate 54.88
    propylene carbonate 91.54
    n-methylformamide 187.26
    2-pentanol 59.67
    n-pentane 4.04
    1-propoxy-2-propanol 116.03
    1-methoxy-2-propyl acetate 118.43
    2-(2-methoxypropoxy) propanol 90.46
    mesitylene 29.42
    ε-caprolactone 98.87
    p-cymene 20.43
    epichlorohydrin 209.58
    1,1,1-trichloroethane 97.87
    2-aminoethanol 131.05
    morpholine-4-carbaldehyde 180.08
    sulfolane 163.41
    2,2,4-trimethylpentane 3.07
    2-methyltetrahydrofuran 143.05
    n-hexyl acetate 53.53
    isooctane 3.83
    2-(2-butoxyethoxy)ethanol 117.03
    sec-butyl acetate 50.24
    tert-butyl acetate 104.46
    decalin 4.35
    glycerin 146.12
    diglyme 204.96
    acrylic acid 73.62
    isopropyl myristate 26.81
    n-butyric acid 94.79
    acetyl acetate 94.49
    di(2-ethylhexyl) phthalate 30.08
    ethyl propionate 65.75
    nitromethane 226.12
    1,2-diethoxyethane 84.35
    benzonitrile 69.79
    trioctyl phosphate 24.18
    1-bromopropane 48.3
    gamma-valerolactone 221.73
    n-decanol 23.79
    triethyl phosphate 34.38
    4-methyl-2-pentanol 52.7
    propionitrile 105.64
    vinylene carbonate 102.22
    1,1,2-trichlorotrifluoroethane 164.97
    DMS 63.89
    cumene 20.78
    2-octanol 25.61
    2-hexanone 59.99
    octyl acetate 31.63
    limonene 22.64
    1,2-dimethoxyethane 232.78
    ethyl orthosilicate 32.85
    tributyl phosphate 24.63
    diacetone alcohol 125.67
    N,N-dimethylaniline 50.95
    acrylonitrile 128.08
    aniline 77.48
    1,3-propanediol 173.41
    bromobenzene 57.63
    dibromomethane 101.89
    1,1,2,2-tetrachloroethane 148.67
    2-methyl-cyclohexyl acetate 47.49
    tetrabutyl urea 34.41
    diisobutyl methanol 27.14
    2-phenylethanol 77.26
    styrene 29.22
    dioctyl adipate 34.3
    dimethyl sulfate 123.73
    ethyl butyrate 49.36
    methyl lactate 92.61
    butyl lactate 47.72
    diethyl carbonate 41.7
    propanediol butyl ether 83.23
    triethyl orthoformate 42.89
    p-tert-butyltoluene 21.17
    methyl 4-tert-butylbenzoate 68.31
    morpholine 258.56
    tert-butylamine 74.33
    n-dodecanol 17.72
    dimethoxymethane 328.54
    ethylene carbonate 89.78
    cyrene 89.92
    2-ethoxyethyl acetate 79.24
    2-ethylhexyl acetate 45.17
    1,2,4-trichlorobenzene 65.29
    4-methylpyridine 106.09
    dibutyl ether 24.72
    2,6-dimethyl-4-heptanol 27.14
    DEF 88.31
    dimethyl isosorbide 132.66
    tetrachloroethylene 99.24
    eugenol 73.31
    triacetin 69.32
    span 80 63.15
    1,4-butanediol 59.6
    1,1-dichloroethane 114.78
    2-methyl-1-pentanol 43.35
    methyl formate 136.44
    2-methyl-1-butanol 61.0
    n-decane 3.06
    butyronitrile 89.67
    3,7-dimethyl-1-octanol 33.4
    1-chlorooctane 14.68
    1-chlorotetradecane 6.58
    n-nonane 2.48
    undecane 2.27
    tert-butylcyclohexane 4.18
    cyclooctane 3.11
    cyclopentanol 82.51
    tetrahydropyran 163.35
    tert-amyl methyl ether 55.21
    2,5,8-trioxanonane 141.49
    1-hexene 10.48
    2-isopropoxyethanol 100.86
    2,2,2-trifluoroethanol 76.75
    methyl butyrate 71.64

    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