(2S,3R,4S,5S,6R)-6-[[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol

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  • Identifiers

    CAS number
    68424-04-4

    Molecular formula
    C12H22O11

    SMILES
    C([C@@H]1[C@H]([C@@H]([C@H](C(O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@H](O2)O)O)O)O)O)O)O)O

  • Odor profile

    Fragrance
    Odorless 70.9%
    Sweet 49.33%
    Woody 24.42%
    Caramellic 23.14%
    Alcoholic 21.64%
    Vanilla 16.59%
    Clean 16.45%
    Milky 15.58%
    Cooling 15.37%
    Bitter 15.28%

     

    Flavor
    Sweet 82.71%
    Odorless 56.03%
    Bitter 45.85%
    Sweet-like 32.14%
    Cauliflower 22.02%
    Very slight 21.92%
    Soup 20.48%
    Fatty 20.44%
    Alkaline 20.31%
    Mentholic 19.95%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    -4.7

    pKa est.
    4.3 (weak acid)

    Molecular weight
    342.3 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    2928°C

    Flash point

    • 269.72 ˚C est.

  • Synonyms

    • 68424-04-4
    • (2S,3R,4S,5S,6R)-6-[[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol
    • ISOMALTOSE
    • 6-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol
    • DLRVVLDZNNYCBX-KNHCDGMMSA-N
    • AKOS037643358
    • AS-15284
    • (2S,3R,4S,5S,6R)-6-({[(3R,4S,5S,6R)-3,4,5-TRIHYDROXY-6-(HYDROXYMETHYL)OXAN-2-YL]OXY}METHYL)OXANE-2,3,4,5-TETROL

  • Applications

    Chemical name: (2S,3R,4S,5S,6R)-6-[[(3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]oxane-2,3,4,5-tetrol; CAS number: 68424-04-4; is a carbohydrate-derived oligosaccharide-like compound that serves as a versatile synthetic building block. It is used as an intermediate for glycosylation in pharmaceutical and agrochemical synthesis and can serve as a platform for oligosaccharide assembly. In cosmetics and personal care, it may act as a polyol humectant and viscosity modifier, contributing to moisturization and formulation stability. In polymers and coatings, it can function as a polyol component or plasticizer in polyurethane and other polyol-based systems, improving flexibility and processability. It is also evaluated as an intermediate in oligosaccharide preparations and as a precursor for glycoside-based fragrance materials; use is subject to local regulations and formulation constraints.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1.79
    methanol 6.62
    isopropanol 0.57
    water 320.7
    ethyl acetate 0.24
    n-propanol 0.73
    acetone 0.44
    n-butanol 0.75
    acetonitrile 0.28
    DMF 31.8
    toluene 0.13
    isobutanol 0.27
    1,4-dioxane 1.61
    methyl acetate 0.17
    THF 1.23
    2-butanone 0.27
    n-pentanol 0.25
    sec-butanol 0.46
    n-hexane 0.03
    ethylene glycol 34.94
    NMP 25.66
    cyclohexane 0.23
    DMSO 218.65
    n-butyl acetate 0.13
    n-octanol 0.39
    chloroform 0.04
    n-propyl acetate 0.08
    acetic acid 7.24
    dichloromethane 0.06
    cyclohexanone 0.85
    propylene glycol 10.96
    isopropyl acetate 0.17
    DMAc 18.94
    2-ethoxyethanol 5.13
    isopentanol 0.35
    n-heptane 0.19
    ethyl formate 0.27
    1,2-dichloroethane 0.11
    n-hexanol 0.36
    2-methoxyethanol 21.67
    isobutyl acetate 0.03
    tetrachloromethane 0.04
    n-pentyl acetate 0.19
    transcutol 8.68
    n-heptanol 0.55
    ethylbenzene 0.06
    MIBK 0.22
    2-propoxyethanol 3.34
    tert-butanol 0.46
    MTBE 0.12
    2-butoxyethanol 2.4
    propionic acid 1.08
    o-xylene 0.21
    formic acid 124.28
    diethyl ether 0.31
    m-xylene 0.15
    p-xylene 0.05
    chlorobenzene 0.03
    dimethyl carbonate 1.05
    n-octane 0.1
    formamide 81.87
    cyclopentanone 1.13
    2-pentanone 0.37
    anisole 0.12
    cyclopentyl methyl ether 0.92
    gamma-butyrolactone 1.51
    1-methoxy-2-propanol 9.75
    pyridine 0.61
    3-pentanone 0.38
    furfural 2.53
    n-dodecane 0.04
    diethylene glycol 14.52
    diisopropyl ether 0.11
    tert-amyl alcohol 0.44
    acetylacetone 0.9
    n-hexadecane 0.05
    acetophenone 0.25
    methyl propionate 0.61
    isopentyl acetate 0.09
    trichloroethylene 0.11
    n-nonanol 0.4
    cyclohexanol 1.22
    benzyl alcohol 0.37
    2-ethylhexanol 0.2
    isooctanol 0.3
    dipropyl ether 0.46
    1,2-dichlorobenzene 0.04
    ethyl lactate 0.74
    propylene carbonate 0.48
    n-methylformamide 8.38
    2-pentanol 0.44
    n-pentane 0.09
    1-propoxy-2-propanol 1.99
    1-methoxy-2-propyl acetate 0.77
    2-(2-methoxypropoxy) propanol 2.26
    mesitylene 0.12
    ε-caprolactone 0.98
    p-cymene 0.11
    epichlorohydrin 0.67
    1,1,1-trichloroethane 0.02
    2-aminoethanol 14.65
    morpholine-4-carbaldehyde 19.22
    sulfolane 12.93
    2,2,4-trimethylpentane 0.03
    2-methyltetrahydrofuran 0.54
    n-hexyl acetate 0.23
    isooctane 0.01
    2-(2-butoxyethoxy)ethanol 3.84
    sec-butyl acetate 0.06
    tert-butyl acetate 0.21
    decalin 0.04
    glycerin 69.94
    diglyme 5.96
    acrylic acid 2.63
    isopropyl myristate 0.1
    n-butyric acid 0.97
    acetyl acetate 0.24
    di(2-ethylhexyl) phthalate 0.18
    ethyl propionate 0.14
    nitromethane 5.41
    1,2-diethoxyethane 0.6
    benzonitrile 0.1
    trioctyl phosphate 0.19
    1-bromopropane 0.06
    gamma-valerolactone 4.83
    n-decanol 0.29
    triethyl phosphate 0.24
    4-methyl-2-pentanol 0.18
    propionitrile 0.14
    vinylene carbonate 0.51
    1,1,2-trichlorotrifluoroethane 5.87
    DMS 0.34
    cumene 0.04
    2-octanol 0.29
    2-hexanone 0.1
    octyl acetate 0.17
    limonene 0.21
    1,2-dimethoxyethane 2.11
    ethyl orthosilicate 0.23
    tributyl phosphate 0.14
    diacetone alcohol 1.6
    N,N-dimethylaniline 0.25
    acrylonitrile 0.31
    aniline 0.44
    1,3-propanediol 11.78
    bromobenzene 0.02
    dibromomethane 0.04
    1,1,2,2-tetrachloroethane 0.16
    2-methyl-cyclohexyl acetate 0.15
    tetrabutyl urea 0.4
    diisobutyl methanol 0.18
    2-phenylethanol 0.36
    styrene 0.04
    dioctyl adipate 0.19
    dimethyl sulfate 4.82
    ethyl butyrate 0.19
    methyl lactate 4.77
    butyl lactate 0.62
    diethyl carbonate 0.11
    propanediol butyl ether 3.5
    triethyl orthoformate 0.31
    p-tert-butyltoluene 0.13
    methyl 4-tert-butylbenzoate 0.85
    morpholine 3.25
    tert-butylamine 0.17
    n-dodecanol 0.21
    dimethoxymethane 5.39
    ethylene carbonate 0.38
    cyrene 4.22
    2-ethoxyethyl acetate 0.43
    2-ethylhexyl acetate 0.08
    1,2,4-trichlorobenzene 0.05
    4-methylpyridine 0.31
    dibutyl ether 0.2
    2,6-dimethyl-4-heptanol 0.18
    DEF 2.72
    dimethyl isosorbide 2.63
    tetrachloroethylene 0.2
    eugenol 1.01
    triacetin 0.62
    span 80 2.14
    1,4-butanediol 2.88
    1,1-dichloroethane 0.02
    2-methyl-1-pentanol 0.14
    methyl formate 3.06
    2-methyl-1-butanol 0.37
    n-decane 0.09
    butyronitrile 0.14
    3,7-dimethyl-1-octanol 0.18
    1-chlorooctane 0.11
    1-chlorotetradecane 0.05
    n-nonane 0.09
    undecane 0.06
    tert-butylcyclohexane 0.02
    cyclooctane 0.17
    cyclopentanol 1.04
    tetrahydropyran 0.65
    tert-amyl methyl ether 0.26
    2,5,8-trioxanonane 5.46
    1-hexene 0.04
    2-isopropoxyethanol 1.44
    2,2,2-trifluoroethanol 7.02
    methyl butyrate 0.18

    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