Chinenoside I

Overview IFRA Request a quote

  • Identifiers

    CAS number
    123941-66-2

    Molecular formula
    C49H80O23

    SMILES
    CC1C2C(CC3C2(CCC4C3CC(=O)C5C4(CCC(C5)OC6C(C(C(C(O6)COC7C(C(C(CO7)O)O)O)OC8C(C(C(CO8)O)O)O)O)O)C)C)OC1(CCC(C)COC9C(C(C(C(O9)CO)O)O)O)O

    Safety labels

  • Odor profile

    Fragrance
    Odorless 62.32%
    Sweet 35.85%
    Woody 29.66%
    Cooling 26.2%
    Spicy 22.7%
    Mint 21.43%
    Warm 18.64%
    Milky 18.64%
    Vanilla 18.06%
    Balsamic 17.05%

     

    Flavor
    Bitter 49.92%
    Sweet 40.16%
    Fatty 38.94%
    Odorless 35.79%
    Sweet-like 29.52%
    Bland 23.67%
    Metallic 22.1%
    Cauliflower 21.56%
    Cedarleaf 20.85%
    Alkaline 20.78%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    -2.9

    pKa est.
    5.01 (weak acid)

    Molecular weight
    1037.1 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    3440°C

    Flash point

    • 233.76 ˚C est.

  • Synonyms

    • Chinenoside I
    • CHEBI:192060
    • DTXSID901100115
    • 123941-66-2
    • 16-[3,4-dihydroxy-5-(3,4,5-trihydroxyoxan-2-yl)oxy-6-[(3,4,5-trihydroxyoxan-2-yl)oxymethyl]oxan-2-yl]oxy-6-hydroxy-7,9,13-trimethyl-6-[3-methyl-4-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybutyl]-5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosan-19-one
    • Furostan-6-one, 3-[(O-I+/--L-arabinopyranosyl-(1a6)-O-[I(2)-D-xylopyranosyl-(1a4)]-I(2)-D-glucopyranosyl)oxy]-26-(I(2)-D-glucopyranosyloxy)-22-hydroxy-, (3I(2),5I+/-,25R)-
    • 123941-66-2

  • Applications

    Chinenoside I (CAS 123941-66-2) is a plant-derived saponin glycoside that is primarily explored for its surfactant properties and potential bioactivity; in real-world contexts it is used or evaluated as a surfactant/emulsifier in cosmetics and personal care formulations, and as a cleansing agent component in household and industrial cleaners. It is also investigated in pharmaceutical R&D as a bioactive glycoside with potential utility in drug-discovery research, and in agriculture as a natural product adjuvant or candidate for crop protection formulations. Additionally, it may serve as an intermediate or starting material for glycoside synthesis and related formulations in coatings, inks, and adhesives where surfactant or emulsifying performance is desired. Subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 0.92
    methanol 9.02
    isopropanol 0.23
    water 0.35
    ethyl acetate 0.6
    n-propanol 0.43
    acetone 1.8
    n-butanol 0.23
    acetonitrile 0.7
    DMF 19.06
    toluene 0.21
    isobutanol 0.16
    1,4-dioxane 3.77
    methyl acetate 0.79
    THF 5.27
    2-butanone 0.82
    n-pentanol 0.22
    sec-butanol 0.13
    n-hexane 0.01
    ethylene glycol 2.94
    NMP 16.71
    cyclohexane 0.02
    DMSO 30.11
    n-butyl acetate 0.34
    n-octanol 0.43
    chloroform 0.83
    n-propyl acetate 0.38
    acetic acid 10.13
    dichloromethane 0.94
    cyclohexanone 1.52
    propylene glycol 1.38
    isopropyl acetate 0.42
    DMAc 14.02
    2-ethoxyethanol 4.06
    isopentanol 0.13
    n-heptane 0.02
    ethyl formate 1.03
    1,2-dichloroethane 0.48
    n-hexanol 0.19
    2-methoxyethanol 9.11
    isobutyl acetate 0.23
    tetrachloromethane 0.12
    n-pentyl acetate 0.94
    transcutol 9.29
    n-heptanol 0.46
    ethylbenzene 0.09
    MIBK 0.42
    2-propoxyethanol 3.54
    tert-butanol 0.14
    MTBE 0.13
    2-butoxyethanol 3.58
    propionic acid 1.04
    o-xylene 0.15
    formic acid 26.3
    diethyl ether 0.28
    m-xylene 0.16
    p-xylene 0.12
    chlorobenzene 0.23
    dimethyl carbonate 2.69
    n-octane 0.01
    formamide 17.99
    cyclopentanone 3.4
    2-pentanone 0.68
    anisole 0.48
    cyclopentyl methyl ether 0.83
    gamma-butyrolactone 5.15
    1-methoxy-2-propanol 3.73
    pyridine 1.98
    3-pentanone 0.57
    furfural 9.91
    n-dodecane 0.01
    diethylene glycol 6.51
    diisopropyl ether 0.06
    tert-amyl alcohol 0.12
    acetylacetone 3.01
    n-hexadecane 0.01
    acetophenone 0.94
    methyl propionate 1.08
    isopentyl acetate 0.28
    trichloroethylene 1.55
    n-nonanol 0.46
    cyclohexanol 0.19
    benzyl alcohol 0.75
    2-ethylhexanol 0.11
    isooctanol 0.28
    dipropyl ether 0.3
    1,2-dichlorobenzene 0.26
    ethyl lactate 1.01
    propylene carbonate 1.72
    n-methylformamide 8.1
    2-pentanol 0.09
    n-pentane 0.01
    1-propoxy-2-propanol 1.77
    1-methoxy-2-propyl acetate 1.61
    2-(2-methoxypropoxy) propanol 2.47
    mesitylene 0.09
    ε-caprolactone 1.61
    p-cymene 0.1
    epichlorohydrin 4.27
    1,1,1-trichloroethane 0.2
    2-aminoethanol 2.41
    morpholine-4-carbaldehyde 21.58
    sulfolane 16.04
    2,2,4-trimethylpentane 0.0
    2-methyltetrahydrofuran 0.69
    n-hexyl acetate 0.92
    isooctane 0.0
    2-(2-butoxyethoxy)ethanol 4.27
    sec-butyl acetate 0.21
    tert-butyl acetate 0.44
    decalin 0.01
    glycerin 7.07
    diglyme 8.89
    acrylic acid 3.07
    isopropyl myristate 0.23
    n-butyric acid 0.86
    acetyl acetate 1.1
    di(2-ethylhexyl) phthalate 0.59
    ethyl propionate 0.38
    nitromethane 16.91
    1,2-diethoxyethane 1.24
    benzonitrile 0.59
    trioctyl phosphate 0.38
    1-bromopropane 0.1
    gamma-valerolactone 15.3
    n-decanol 0.26
    triethyl phosphate 0.31
    4-methyl-2-pentanol 0.07
    propionitrile 0.3
    vinylene carbonate 2.62
    1,1,2-trichlorotrifluoroethane 10.64
    DMS 1.15
    cumene 0.06
    2-octanol 0.23
    2-hexanone 0.41
    octyl acetate 0.48
    limonene 0.11
    1,2-dimethoxyethane 4.46
    ethyl orthosilicate 0.26
    tributyl phosphate 0.28
    diacetone alcohol 1.35
    N,N-dimethylaniline 0.45
    acrylonitrile 0.96
    aniline 0.45
    1,3-propanediol 1.93
    bromobenzene 0.19
    dibromomethane 0.33
    1,1,2,2-tetrachloroethane 0.99
    2-methyl-cyclohexyl acetate 0.36
    tetrabutyl urea 0.62
    diisobutyl methanol 0.07
    2-phenylethanol 0.68
    styrene 0.11
    dioctyl adipate 0.63
    dimethyl sulfate 6.97
    ethyl butyrate 0.36
    methyl lactate 3.29
    butyl lactate 1.44
    diethyl carbonate 0.25
    propanediol butyl ether 4.2
    triethyl orthoformate 0.45
    p-tert-butyltoluene 0.09
    methyl 4-tert-butylbenzoate 2.0
    morpholine 3.47
    tert-butylamine 0.04
    n-dodecanol 0.15
    dimethoxymethane 8.34
    ethylene carbonate 1.34
    cyrene 5.63
    2-ethoxyethyl acetate 2.84
    2-ethylhexyl acetate 0.22
    1,2,4-trichlorobenzene 0.41
    4-methylpyridine 1.01
    dibutyl ether 0.22
    2,6-dimethyl-4-heptanol 0.07
    DEF 1.85
    dimethyl isosorbide 4.89
    tetrachloroethylene 0.91
    eugenol 2.51
    triacetin 2.52
    span 80 2.51
    1,4-butanediol 1.01
    1,1-dichloroethane 0.2
    2-methyl-1-pentanol 0.12
    methyl formate 7.94
    2-methyl-1-butanol 0.13
    n-decane 0.03
    butyronitrile 0.23
    3,7-dimethyl-1-octanol 0.19
    1-chlorooctane 0.11
    1-chlorotetradecane 0.03
    n-nonane 0.02
    undecane 0.02
    tert-butylcyclohexane 0.01
    cyclooctane 0.01
    cyclopentanol 0.35
    tetrahydropyran 0.65
    tert-amyl methyl ether 0.15
    2,5,8-trioxanonane 5.74
    1-hexene 0.03
    2-isopropoxyethanol 1.67
    2,2,2-trifluoroethanol 5.02
    methyl butyrate 0.52

    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