9,19-Cyclolanostan-28-oic acid, 1,3,20,24-tetrahydroxy-24-(hydroxymethyl)-, I(2)-D-glucopyranosyl ester, (1I+/-,3I(2),4I+/-,24S)-

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  • Identifiers

    CAS number
    292167-41-0

    Molecular formula
    C37H62O12

    SMILES
    CC(C)[C@@](CC[C@@](C)([C@H]1CC[C@@]2([C@@]1(CC[C@]34[C@H]2CC[C@@H]5[C@]3(C4)[C@H](C[C@@H]([C@@]5(C)C(=O)O[C@H]6[C@@H]([C@H]([C@@H]([C@H](O6)CO)O)O)O)O)O)C)C)O)(CO)O

    Safety labels

  • Odor profile

    Fragrance
    Woody 51.65%
    Odorless 51.08%
    Amber 34.1%
    Cooling 33.7%
    Sweet 33.26%
    Balsamic 32.46%
    Sandalwood 31.12%
    Mint 29.27%
    Dry 28.09%
    Musk 26.05%

     

    Flavor
    Bitter 55.98%
    Odorless 35.91%
    Sweet 29.88%
    Sweet-like 26.98%
    Fatty 24.94%
    Bland 24.36%
    Cedarleaf 21.92%
    Mild 21.67%
    Fir 21.15%
    Clary 21.14%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    2.7

    pKa est.
    5.4 (weak acid)

    Molecular weight
    698.9 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    709°C

    Flash point

    • 254.48 ˚C est.

  • Synonyms

    • DTXSID501105925
    • 292167-41-0
    • 9,19-Cyclolanostan-28-oic acid, 1,3,20,24-tetrahydroxy-24-(hydroxymethyl)-, I(2)-D-glucopyranosyl ester, (1I+/-,3I(2),4I+/-,24S)-
    • 292167-41-0

  • Applications

    9,19-Cyclolanostan-28-oic acid, 1,3,20,24-tetrahydroxy-24-(hydroxymethyl)-, I(2)-D-glucopyranosyl ester, (1I+/-,3I(2),4I+/-,24S)- (CAS 292167-41-0) can function as a natural triterpenoid glycoside with potential applications as a surfactant and emulsifier in cosmetics, personal care, and cleaning products; it may serve as an intermediate for the synthesis of other saponin or triterpenoid glycoside derivatives; it could also be evaluated as an additive in coatings, inks, and polymer formulations to improve stability and emulsification; and it is of interest as a starting material for developing glycoside-derived compounds in research and development.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3.97
    methanol 25.82
    isopropanol 1.05
    water 0.07
    ethyl acetate 1.77
    n-propanol 1.8
    acetone 4.66
    n-butanol 0.81
    acetonitrile 1.23
    DMF 31.4
    toluene 0.23
    isobutanol 0.65
    1,4-dioxane 8.91
    methyl acetate 2.45
    THF 17.39
    2-butanone 2.68
    n-pentanol 0.57
    sec-butanol 0.57
    n-hexane 0.02
    ethylene glycol 5.94
    NMP 27.32
    cyclohexane 0.03
    DMSO 46.55
    n-butyl acetate 0.76
    n-octanol 0.52
    chloroform 2.77
    n-propyl acetate 0.83
    acetic acid 26.5
    dichloromethane 2.53
    cyclohexanone 3.36
    propylene glycol 4.53
    isopropyl acetate 1.06
    DMAc 26.57
    2-ethoxyethanol 9.25
    isopentanol 0.46
    n-heptane 0.02
    ethyl formate 2.25
    1,2-dichloroethane 1.3
    n-hexanol 0.53
    2-methoxyethanol 25.34
    isobutyl acetate 0.43
    tetrachloromethane 0.37
    n-pentyl acetate 1.29
    transcutol 13.29
    n-heptanol 0.72
    ethylbenzene 0.12
    MIBK 0.92
    2-propoxyethanol 9.91
    tert-butanol 0.71
    MTBE 0.57
    2-butoxyethanol 6.23
    propionic acid 3.4
    o-xylene 0.17
    formic acid 29.21
    diethyl ether 0.97
    m-xylene 0.16
    p-xylene 0.13
    chlorobenzene 0.35
    dimethyl carbonate 4.05
    n-octane 0.01
    formamide 22.29
    cyclopentanone 8.72
    2-pentanone 1.65
    anisole 0.87
    cyclopentyl methyl ether 1.79
    gamma-butyrolactone 13.42
    1-methoxy-2-propanol 11.25
    pyridine 3.67
    3-pentanone 1.33
    furfural 11.58
    n-dodecane 0.01
    diethylene glycol 13.59
    diisopropyl ether 0.17
    tert-amyl alcohol 0.53
    acetylacetone 4.85
    n-hexadecane 0.01
    acetophenone 1.21
    methyl propionate 2.73
    isopentyl acetate 0.67
    trichloroethylene 3.91
    n-nonanol 0.55
    cyclohexanol 0.44
    benzyl alcohol 1.18
    2-ethylhexanol 0.22
    isooctanol 0.44
    dipropyl ether 0.58
    1,2-dichlorobenzene 0.4
    ethyl lactate 1.65
    propylene carbonate 3.76
    n-methylformamide 15.87
    2-pentanol 0.33
    n-pentane 0.02
    1-propoxy-2-propanol 3.72
    1-methoxy-2-propyl acetate 3.63
    2-(2-methoxypropoxy) propanol 3.54
    mesitylene 0.09
    ε-caprolactone 4.0
    p-cymene 0.1
    epichlorohydrin 11.39
    1,1,1-trichloroethane 0.64
    2-aminoethanol 7.31
    morpholine-4-carbaldehyde 31.52
    sulfolane 24.82
    2,2,4-trimethylpentane 0.01
    2-methyltetrahydrofuran 2.63
    n-hexyl acetate 1.36
    isooctane 0.01
    2-(2-butoxyethoxy)ethanol 5.86
    sec-butyl acetate 0.46
    tert-butyl acetate 1.18
    decalin 0.02
    glycerin 15.93
    diglyme 13.04
    acrylic acid 6.95
    isopropyl myristate 0.29
    n-butyric acid 3.05
    acetyl acetate 2.13
    di(2-ethylhexyl) phthalate 0.64
    ethyl propionate 0.91
    nitromethane 30.18
    1,2-diethoxyethane 2.05
    benzonitrile 0.63
    trioctyl phosphate 0.45
    1-bromopropane 0.3
    gamma-valerolactone 29.93
    n-decanol 0.29
    triethyl phosphate 0.57
    4-methyl-2-pentanol 0.22
    propionitrile 0.75
    vinylene carbonate 4.3
    1,1,2-trichlorotrifluoroethane 21.48
    DMS 2.06
    cumene 0.09
    2-octanol 0.31
    2-hexanone 0.84
    octyl acetate 0.58
    limonene 0.15
    1,2-dimethoxyethane 9.45
    ethyl orthosilicate 0.5
    tributyl phosphate 0.39
    diacetone alcohol 3.21
    N,N-dimethylaniline 0.64
    acrylonitrile 1.81
    aniline 0.7
    1,3-propanediol 6.71
    bromobenzene 0.26
    dibromomethane 1.0
    1,1,2,2-tetrachloroethane 2.8
    2-methyl-cyclohexyl acetate 0.65
    tetrabutyl urea 0.65
    diisobutyl methanol 0.14
    2-phenylethanol 1.22
    styrene 0.14
    dioctyl adipate 0.68
    dimethyl sulfate 9.85
    ethyl butyrate 0.72
    methyl lactate 6.3
    butyl lactate 1.87
    diethyl carbonate 0.55
    propanediol butyl ether 5.21
    triethyl orthoformate 0.8
    p-tert-butyltoluene 0.1
    methyl 4-tert-butylbenzoate 2.47
    morpholine 10.46
    tert-butylamine 0.18
    n-dodecanol 0.15
    dimethoxymethane 16.9
    ethylene carbonate 2.85
    cyrene 6.84
    2-ethoxyethyl acetate 4.33
    2-ethylhexyl acetate 0.44
    1,2,4-trichlorobenzene 0.66
    4-methylpyridine 1.61
    dibutyl ether 0.29
    2,6-dimethyl-4-heptanol 0.14
    DEF 3.37
    dimethyl isosorbide 6.57
    tetrachloroethylene 2.21
    eugenol 2.81
    triacetin 3.35
    span 80 3.2
    1,4-butanediol 1.96
    1,1-dichloroethane 0.66
    2-methyl-1-pentanol 0.35
    methyl formate 12.58
    2-methyl-1-butanol 0.46
    n-decane 0.02
    butyronitrile 0.55
    3,7-dimethyl-1-octanol 0.29
    1-chlorooctane 0.12
    1-chlorotetradecane 0.03
    n-nonane 0.02
    undecane 0.01
    tert-butylcyclohexane 0.01
    cyclooctane 0.02
    cyclopentanol 1.07
    tetrahydropyran 1.95
    tert-amyl methyl ether 0.49
    2,5,8-trioxanonane 7.18
    1-hexene 0.07
    2-isopropoxyethanol 3.31
    2,2,2-trifluoroethanol 9.5
    methyl butyrate 1.15

    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