Arabinopyranose cyclic 3,4-(4,4',5,5',6,6'-hexahydroxydiphenate)

Overview IFRA Request a quote

  • Identifiers

    CAS number
    19833-16-0

    Molecular formula
    C19H16O13

    SMILES
    C1[C@H]2[C@@H]([C@H](C(O1)O)O)OC(=O)C3=CC(=C(C(=C3C4=C(C(=C(C=C4C(=O)O2)O)O)O)O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Odorless 78.79%
    Phenolic 37.65%
    Burnt 27.22%
    Smoky 19.39%
    Balsamic 17.73%
    Vanilla 17.69%
    Spicy 17.27%
    Savory 16.27%
    Milky 14.99%
    Bitter 14.71%

     

    Flavor
    Bitter 82.99%
    Odorless 32.02%
    Bland 28.4%
    Sweet-like 24.73%
    Very mild 20.59%
    Eugenol 19.94%
    Cedarleaf 19.9%
    Lovage 19.63%
    Parsley 19.62%
    Fenugreek 19.53%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    -0.5

    pKa est.
    6.61 (neutral)

    Molecular weight
    452.3 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    3967°C

    Flash point

    • 346.72 ˚C est.

  • Synonyms

    • DTXSID501157188
    • Arabinopyranose cyclic 3,4-(4,4',5,5',6,6'-hexahydroxydiphenate)
    • Arabinopyranose, cyclic 3,4-(4,4a(2),5,5a(2),6,6a(2)-hexahydroxydiphenate), L-
    • (4R,4aR,16aS)-3,4,8,9,10,11,12,13-Octahydroxy-3,4,4a,16a-tetrahydro-1H-dibenzo[f,h]pyrano[3,4-b][1,4]dioxecine-6,15-dione
    • 19833-16-0
    • 19833-16-0

  • Applications

    Arabinopyranose cyclic 3,4-(4,4',5,5',6,6'-hexahydroxydiphenate) (CAS 19833-16-0) is primarily considered as an organic building block and intermediate for synthetic chemistry. In practice, it may be used as a chiral or stereochemical foundation for the preparation of advanced polymers and functional materials, and as a potential antioxidant or stabilizer in polymers, coatings, and cosmetic formulations due to its multiple phenolic hydroxyl groups. It may also serve as a chelating agent or complexing component in cleaning and agricultural formulations, and could function as a crosslinking or plasticizing additive in polymer systems, as well as a potential precursor in pharmaceutical intermediate synthesis, with use being highly dependent on formulation and regulatory constraints.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 9.02
    methanol 7.73
    isopropanol 5.16
    water 0.92
    ethyl acetate 3.4
    n-propanol 5.18
    acetone 4.75
    n-butanol 1.96
    acetonitrile 2.1
    DMF 91.97
    toluene 0.34
    isobutanol 1.5
    1,4-dioxane 14.27
    methyl acetate 5.22
    THF 20.36
    2-butanone 4.2
    n-pentanol 1.06
    sec-butanol 3.0
    n-hexane 0.03
    ethylene glycol 35.62
    NMP 71.82
    cyclohexane 0.08
    DMSO 87.36
    n-butyl acetate 1.7
    n-octanol 1.94
    chloroform 0.14
    n-propyl acetate 1.78
    acetic acid 31.11
    dichloromethane 0.22
    cyclohexanone 3.22
    propylene glycol 28.23
    isopropyl acetate 1.81
    DMAc 84.89
    2-ethoxyethanol 40.08
    isopentanol 0.91
    n-heptane 0.12
    ethyl formate 3.24
    1,2-dichloroethane 0.34
    n-hexanol 0.93
    2-methoxyethanol 96.37
    isobutyl acetate 0.35
    tetrachloromethane 0.05
    n-pentyl acetate 1.98
    transcutol 34.36
    n-heptanol 2.03
    ethylbenzene 0.14
    MIBK 0.71
    2-propoxyethanol 24.14
    tert-butanol 3.51
    MTBE 1.27
    2-butoxyethanol 14.67
    propionic acid 9.29
    o-xylene 0.31
    formic acid 64.51
    diethyl ether 2.16
    m-xylene 0.19
    p-xylene 0.14
    chlorobenzene 0.08
    dimethyl carbonate 10.86
    n-octane 0.1
    formamide 90.47
    cyclopentanone 9.06
    2-pentanone 1.97
    anisole 0.98
    cyclopentyl methyl ether 4.0
    gamma-butyrolactone 20.91
    1-methoxy-2-propanol 50.9
    pyridine 5.54
    3-pentanone 1.69
    furfural 12.07
    n-dodecane 0.07
    diethylene glycol 41.88
    diisopropyl ether 0.37
    tert-amyl alcohol 2.49
    acetylacetone 5.25
    n-hexadecane 0.08
    acetophenone 1.33
    methyl propionate 6.71
    isopentyl acetate 0.91
    trichloroethylene 0.54
    n-nonanol 1.95
    cyclohexanol 1.62
    benzyl alcohol 1.57
    2-ethylhexanol 0.52
    isooctanol 1.08
    dipropyl ether 2.41
    1,2-dichlorobenzene 0.08
    ethyl lactate 6.01
    propylene carbonate 4.67
    n-methylformamide 35.78
    2-pentanol 1.2
    n-pentane 0.05
    1-propoxy-2-propanol 14.97
    1-methoxy-2-propyl acetate 7.1
    2-(2-methoxypropoxy) propanol 10.32
    mesitylene 0.12
    ε-caprolactone 6.2
    p-cymene 0.2
    epichlorohydrin 8.27
    1,1,1-trichloroethane 0.09
    2-aminoethanol 32.13
    morpholine-4-carbaldehyde 76.06
    sulfolane 35.6
    2,2,4-trimethylpentane 0.02
    2-methyltetrahydrofuran 5.57
    n-hexyl acetate 2.25
    isooctane 0.01
    2-(2-butoxyethoxy)ethanol 16.39
    sec-butyl acetate 0.77
    tert-butyl acetate 1.81
    decalin 0.03
    glycerin 86.38
    diglyme 28.81
    acrylic acid 14.57
    isopropyl myristate 0.89
    n-butyric acid 4.71
    acetyl acetate 2.03
    di(2-ethylhexyl) phthalate 1.06
    ethyl propionate 2.11
    nitromethane 38.42
    1,2-diethoxyethane 5.0
    benzonitrile 0.58
    trioctyl phosphate 1.16
    1-bromopropane 0.16
    gamma-valerolactone 35.45
    n-decanol 1.36
    triethyl phosphate 1.6
    4-methyl-2-pentanol 0.45
    propionitrile 1.38
    vinylene carbonate 3.99
    1,1,2-trichlorotrifluoroethane 20.82
    DMS 3.59
    cumene 0.08
    2-octanol 1.22
    2-hexanone 0.92
    octyl acetate 1.72
    limonene 0.31
    1,2-dimethoxyethane 24.15
    ethyl orthosilicate 1.39
    tributyl phosphate 0.96
    diacetone alcohol 7.73
    N,N-dimethylaniline 1.1
    acrylonitrile 2.98
    aniline 1.65
    1,3-propanediol 24.46
    bromobenzene 0.05
    dibromomethane 0.09
    1,1,2,2-tetrachloroethane 0.61
    2-methyl-cyclohexyl acetate 1.02
    tetrabutyl urea 2.59
    diisobutyl methanol 0.39
    2-phenylethanol 1.41
    styrene 0.15
    dioctyl adipate 1.83
    dimethyl sulfate 21.87
    ethyl butyrate 1.83
    methyl lactate 22.87
    butyl lactate 4.59
    diethyl carbonate 1.59
    propanediol butyl ether 14.6
    triethyl orthoformate 2.56
    p-tert-butyltoluene 0.22
    methyl 4-tert-butylbenzoate 3.84
    morpholine 28.03
    tert-butylamine 0.94
    n-dodecanol 0.93
    dimethoxymethane 36.9
    ethylene carbonate 3.36
    cyrene 12.58
    2-ethoxyethyl acetate 5.4
    2-ethylhexyl acetate 0.69
    1,2,4-trichlorobenzene 0.22
    4-methylpyridine 2.28
    dibutyl ether 1.23
    2,6-dimethyl-4-heptanol 0.39
    DEF 10.44
    dimethyl isosorbide 12.25
    tetrachloroethylene 0.5
    eugenol 4.51
    triacetin 5.22
    span 80 8.6
    1,4-butanediol 7.82
    1,1-dichloroethane 0.13
    2-methyl-1-pentanol 0.5
    methyl formate 18.86
    2-methyl-1-butanol 1.11
    n-decane 0.14
    butyronitrile 0.73
    3,7-dimethyl-1-octanol 0.73
    1-chlorooctane 0.32
    1-chlorotetradecane 0.14
    n-nonane 0.13
    undecane 0.09
    tert-butylcyclohexane 0.02
    cyclooctane 0.05
    cyclopentanol 3.9
    tetrahydropyran 3.81
    tert-amyl methyl ether 1.49
    2,5,8-trioxanonane 20.1
    1-hexene 0.1
    2-isopropoxyethanol 13.0
    2,2,2-trifluoroethanol 14.28
    methyl butyrate 2.36

    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