Trichocarposide

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  • Identifiers

    CAS number
    17063-94-4

    Molecular formula
    C22H24O9

    SMILES
    C1=CC=C(C(=C1)CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)/C=C/C3=CC=C(C=C3)O)O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Odorless 50.87%
    Sweet 48.5%
    Vanilla 40.7%
    Balsamic 36.65%
    Spicy 32.62%
    Bitter 23.91%
    Phenolic 23.81%
    Aromatic 21.69%
    Milky 21.21%
    Creamy 20.44%

     

    Flavor
    Bitter 77.4%
    Odorless 34.3%
    Bland 28.23%
    Sweet-like 24.23%
    Very mild 21.53%
    Mild 20.56%
    Ethyl benzoate 20.34%
    Lovage 19.84%
    Orange flower 19.78%
    Parsley 19.69%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    0.5

    pKa est.
    7.23 (neutral)

    Molecular weight
    432.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    1686°C

    Flash point

    • 264.96 ˚C est.

  • Synonyms

    • Trichocarposide
    • 17063-94-4
    • RefChem:191088
    • DTXSID501316934
    • 2-(Hydroxymethyl)phenyl 6-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranoside
    • 17063-94-4

  • Applications

    Trichocarposide (CAS 17063-94-4) is a specialty chemical with potential uses as an intermediate in organic synthesis and as a processing aid in various industrial formulations. Potential applications span polymers/plastics as a functional additive or precursor, coatings/inks as a processing or surface-modifying additive, cosmetics/personal care as a fragrance precursor or active ingredient, and cleaning/household products as a solvent or stabilizer. Actual use depends on its physicochemical properties and regulatory status, and any application would be pursued under applicable regulations and formulation constraints.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 55.1
    methanol 115.78
    isopropanol 43.09
    water 4.24
    ethyl acetate 27.26
    n-propanol 42.69
    acetone 163.18
    n-butanol 34.9
    acetonitrile 28.69
    DMF 141.31
    toluene 3.56
    isobutanol 12.05
    1,4-dioxane 83.3
    methyl acetate 25.25
    THF 257.22
    2-butanone 50.31
    n-pentanol 10.3
    sec-butanol 23.24
    n-hexane 0.16
    ethylene glycol 79.55
    NMP 59.66
    cyclohexane 0.71
    DMSO 1166.92
    n-butyl acetate 1.17
    n-octanol 5.06
    chloroform 2.05
    n-propyl acetate 2.4
    acetic acid 188.65
    dichloromethane 2.73
    cyclohexanone 36.33
    propylene glycol 82.49
    isopropyl acetate 11.29
    DMAc 213.16
    2-ethoxyethanol 117.23
    isopentanol 12.88
    n-heptane 0.48
    ethyl formate 14.28
    1,2-dichloroethane 4.98
    n-hexanol 3.32
    2-methoxyethanol 346.46
    isobutyl acetate 0.77
    tetrachloromethane 0.47
    n-pentyl acetate 3.06
    transcutol 108.58
    n-heptanol 4.94
    ethylbenzene 0.86
    MIBK 10.92
    2-propoxyethanol 32.58
    tert-butanol 28.5
    MTBE 7.9
    2-butoxyethanol 19.48
    propionic acid 33.66
    o-xylene 2.13
    formic acid 172.38
    diethyl ether 18.9
    m-xylene 1.68
    p-xylene 0.77
    chlorobenzene 1.0
    dimethyl carbonate 28.44
    n-octane 0.35
    formamide 267.3
    cyclopentanone 81.14
    2-pentanone 43.24
    anisole 4.94
    cyclopentyl methyl ether 26.95
    gamma-butyrolactone 64.04
    1-methoxy-2-propanol 185.43
    pyridine 24.2
    3-pentanone 20.42
    furfural 29.76
    n-dodecane 0.29
    diethylene glycol 56.09
    diisopropyl ether 2.07
    tert-amyl alcohol 14.98
    acetylacetone 77.02
    n-hexadecane 0.32
    acetophenone 5.59
    methyl propionate 33.95
    isopentyl acetate 1.02
    trichloroethylene 6.82
    n-nonanol 5.35
    cyclohexanol 18.37
    benzyl alcohol 9.01
    2-ethylhexanol 1.26
    isooctanol 2.92
    dipropyl ether 5.06
    1,2-dichlorobenzene 0.78
    ethyl lactate 7.38
    propylene carbonate 9.35
    n-methylformamide 96.87
    2-pentanol 15.86
    n-pentane 0.36
    1-propoxy-2-propanol 16.44
    1-methoxy-2-propyl acetate 7.57
    2-(2-methoxypropoxy) propanol 18.95
    mesitylene 0.88
    ε-caprolactone 19.96
    p-cymene 0.53
    epichlorohydrin 63.42
    1,1,1-trichloroethane 1.66
    2-aminoethanol 97.33
    morpholine-4-carbaldehyde 88.66
    sulfolane 112.5
    2,2,4-trimethylpentane 0.14
    2-methyltetrahydrofuran 41.76
    n-hexyl acetate 4.17
    isooctane 0.08
    2-(2-butoxyethoxy)ethanol 33.61
    sec-butyl acetate 1.58
    tert-butyl acetate 9.36
    decalin 0.16
    glycerin 163.19
    diglyme 62.82
    acrylic acid 43.59
    isopropyl myristate 2.13
    n-butyric acid 35.52
    acetyl acetate 14.62
    di(2-ethylhexyl) phthalate 2.48
    ethyl propionate 4.03
    nitromethane 263.85
    1,2-diethoxyethane 14.31
    benzonitrile 2.64
    trioctyl phosphate 2.18
    1-bromopropane 1.98
    gamma-valerolactone 105.4
    n-decanol 4.01
    triethyl phosphate 1.65
    4-methyl-2-pentanol 3.85
    propionitrile 10.08
    vinylene carbonate 8.04
    1,1,2-trichlorotrifluoroethane 55.6
    DMS 4.88
    cumene 0.44
    2-octanol 2.91
    2-hexanone 4.82
    octyl acetate 3.55
    limonene 0.97
    1,2-dimethoxyethane 67.48
    ethyl orthosilicate 1.76
    tributyl phosphate 1.78
    diacetone alcohol 36.7
    N,N-dimethylaniline 3.51
    acrylonitrile 16.19
    aniline 11.5
    1,3-propanediol 142.43
    bromobenzene 0.67
    dibromomethane 1.51
    1,1,2,2-tetrachloroethane 6.97
    2-methyl-cyclohexyl acetate 1.56
    tetrabutyl urea 4.04
    diisobutyl methanol 1.21
    2-phenylethanol 3.87
    styrene 0.98
    dioctyl adipate 4.19
    dimethyl sulfate 42.39
    ethyl butyrate 1.91
    methyl lactate 47.29
    butyl lactate 5.35
    diethyl carbonate 1.33
    propanediol butyl ether 24.21
    triethyl orthoformate 2.6
    p-tert-butyltoluene 0.58
    methyl 4-tert-butylbenzoate 8.23
    morpholine 117.4
    tert-butylamine 5.28
    n-dodecanol 2.94
    dimethoxymethane 166.94
    ethylene carbonate 7.77
    cyrene 22.55
    2-ethoxyethyl acetate 8.27
    2-ethylhexyl acetate 0.64
    1,2,4-trichlorobenzene 1.39
    4-methylpyridine 11.44
    dibutyl ether 3.92
    2,6-dimethyl-4-heptanol 1.21
    DEF 39.5
    dimethyl isosorbide 20.26
    tetrachloroethylene 4.37
    eugenol 8.92
    triacetin 9.42
    span 80 15.19
    1,4-butanediol 33.0
    1,1-dichloroethane 2.62
    2-methyl-1-pentanol 4.44
    methyl formate 75.28
    2-methyl-1-butanol 11.33
    n-decane 0.52
    butyronitrile 9.11
    3,7-dimethyl-1-octanol 2.72
    1-chlorooctane 1.33
    1-chlorotetradecane 0.6
    n-nonane 0.44
    undecane 0.37
    tert-butylcyclohexane 0.09
    cyclooctane 0.36
    cyclopentanol 34.47
    tetrahydropyran 44.38
    tert-amyl methyl ether 7.33
    2,5,8-trioxanonane 48.74
    1-hexene 0.61
    2-isopropoxyethanol 34.42
    2,2,2-trifluoroethanol 48.53
    methyl butyrate 4.84

    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