9,19-Cyclolanostan-28-oic acid, 1,3,20,24-tetrahydroxy-24-(hydroxymethyl)-, (1alpha,3beta,4alpha,24S)-

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  • Identifiers

    CAS number
    292167-36-3

    Molecular formula
    C31H52O7

    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)O)O)C)C)O)(CO)O

    Safety labels

  • Odor profile

    Fragrance
    Woody 69.35%
    Amber 44.19%
    Balsamic 41.79%
    Sandalwood 41.05%
    Odorless 36.47%
    Dry 36.12%
    Sweet 33.4%
    Cedar 33.13%
    Musk 32.18%
    Cooling 31.98%

     

    Flavor
    Bitter 44.19%
    Odorless 33.85%
    Sweet 33.45%
    Woody 30.68%
    Mild 25.47%
    Fruity 24.95%
    Pine 24.79%
    Herbal 23.92%
    Sweet-like 23.81%
    Fruit 22.5%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    4.5

    pKa est.
    6.25 (neutral)

    Molecular weight
    536.7 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra fast

    Boiling point est.
    131°C

    Flash point

    • 250.19 ˚C est.

  • Synonyms

    • 292167-36-3
    • (1S,3S,4S,6S,7S,8R,11S,12S,15S,16R)-15-((2S,5S)-2,5-dihydroxy-5-(hydroxymethyl)-6-methylheptan-2-yl)-4,6-dihydroxy-7,12,16-trimethylpentacyclo(9.7.0.01,3.03,8.012,16)octadecane-7-carboxylic acid
    • (1S,3S,4S,6S,7S,8R,11S,12S,15S,16R)-15-[(2S,5S)-2,5-dihydroxy-5-(hydroxymethyl)-6-methylheptan-2-yl]-4,6-dihydroxy-7,12,16-trimethylpentacyclo[9.7.0.01,3.03,8.012,16]octadecane-7-carboxylic acid
    • RefChem:107581
    • 9,19-Cyclolanostan-28-oic acid, 1,3,20,24-tetrahydroxy-24-(hydroxymethyl)-, (1alpha,3beta,4alpha,24S)-
    • DTXSID101120670
    • (24S)-1alpha,3beta,20,24-Tetrahydroxy-24-(hydroxymethyl)-9beta-9,19-cyclolanostan-28-oic acid
    • 9,19-Cyclolanostan-28-oic acid, 1,3,20,24-tetrahydroxy-24-(hydroxymethyl)-, (1I+/-,3I(2),4I+/-,24S)-
    • 292167-36-3

  • Applications

    9,19-Cyclolanostan-28-oic acid, 1,3,20,24-tetrahydroxy-24-(hydroxymethyl)-, (1alpha,3beta,4alpha,24S)- (CAS 292167-36-3) is a multifunctional sterol-derived building block, primarily considered as an intermediate in chemical synthesis. It is commonly evaluated as an intermediate for steroidal and triterpenoid derivatives in pharmaceutical research; its multiple hydroxyl groups allow it to function as a polyol-type component in specialty polymers and polyurethane coatings; it may serve as a starting material for derivatization to ester or glycoside forms related to cosmetics or fragrance; in industrial manufacturing it provides a chiral, highly functional scaffold for downstream transformations aimed at producing derivatives for agrochemical applications or materials.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 10.27
    methanol 27.5
    isopropanol 2.76
    water 0.04
    ethyl acetate 2.46
    n-propanol 4.99
    acetone 5.75
    n-butanol 2.37
    acetonitrile 1.34
    DMF 43.01
    toluene 0.47
    isobutanol 1.79
    1,4-dioxane 14.12
    methyl acetate 2.7
    THF 40.96
    2-butanone 4.08
    n-pentanol 1.67
    sec-butanol 1.31
    n-hexane 0.05
    ethylene glycol 5.3
    NMP 26.23
    cyclohexane 0.05
    DMSO 45.18
    n-butyl acetate 1.81
    n-octanol 1.02
    chloroform 4.19
    n-propyl acetate 1.47
    acetic acid 14.98
    dichloromethane 3.34
    cyclohexanone 5.73
    propylene glycol 6.21
    isopropyl acetate 1.87
    DMAc 28.84
    2-ethoxyethanol 14.36
    isopentanol 1.3
    n-heptane 0.05
    ethyl formate 2.65
    1,2-dichloroethane 1.87
    n-hexanol 1.78
    2-methoxyethanol 36.57
    isobutyl acetate 0.98
    tetrachloromethane 0.58
    n-pentyl acetate 2.59
    transcutol 18.7
    n-heptanol 1.78
    ethylbenzene 0.29
    MIBK 2.11
    2-propoxyethanol 21.82
    tert-butanol 1.63
    MTBE 1.3
    2-butoxyethanol 11.7
    propionic acid 4.03
    o-xylene 0.31
    formic acid 15.54
    diethyl ether 2.15
    m-xylene 0.35
    p-xylene 0.29
    chlorobenzene 0.63
    dimethyl carbonate 4.16
    n-octane 0.03
    formamide 15.98
    cyclopentanone 13.89
    2-pentanone 3.16
    anisole 1.71
    cyclopentyl methyl ether 3.9
    gamma-butyrolactone 16.62
    1-methoxy-2-propanol 22.63
    pyridine 5.85
    3-pentanone 2.09
    furfural 11.82
    n-dodecane 0.01
    diethylene glycol 20.89
    diisopropyl ether 0.37
    tert-amyl alcohol 1.14
    acetylacetone 6.05
    n-hexadecane 0.02
    acetophenone 2.14
    methyl propionate 3.64
    isopentyl acetate 1.7
    trichloroethylene 4.72
    n-nonanol 1.12
    cyclohexanol 0.98
    benzyl alcohol 2.41
    2-ethylhexanol 0.65
    isooctanol 1.18
    dipropyl ether 1.29
    1,2-dichlorobenzene 0.67
    ethyl lactate 2.38
    propylene carbonate 4.52
    n-methylformamide 17.62
    2-pentanol 0.88
    n-pentane 0.05
    1-propoxy-2-propanol 9.23
    1-methoxy-2-propyl acetate 6.54
    2-(2-methoxypropoxy) propanol 6.28
    mesitylene 0.19
    ε-caprolactone 6.05
    p-cymene 0.24
    epichlorohydrin 16.82
    1,1,1-trichloroethane 0.95
    2-aminoethanol 11.38
    morpholine-4-carbaldehyde 35.4
    sulfolane 24.7
    2,2,4-trimethylpentane 0.03
    2-methyltetrahydrofuran 5.59
    n-hexyl acetate 2.66
    isooctane 0.02
    2-(2-butoxyethoxy)ethanol 9.96
    sec-butyl acetate 0.88
    tert-butyl acetate 2.29
    decalin 0.04
    glycerin 16.53
    diglyme 19.5
    acrylic acid 5.97
    isopropyl myristate 0.55
    n-butyric acid 4.54
    acetyl acetate 2.22
    di(2-ethylhexyl) phthalate 1.3
    ethyl propionate 1.52
    nitromethane 18.15
    1,2-diethoxyethane 3.41
    benzonitrile 1.06
    trioctyl phosphate 0.88
    1-bromopropane 0.6
    gamma-valerolactone 36.86
    n-decanol 0.56
    triethyl phosphate 1.0
    4-methyl-2-pentanol 0.62
    propionitrile 1.24
    vinylene carbonate 4.91
    1,1,2-trichlorotrifluoroethane 20.02
    DMS 2.81
    cumene 0.22
    2-octanol 0.7
    2-hexanone 1.8
    octyl acetate 1.05
    limonene 0.32
    1,2-dimethoxyethane 14.81
    ethyl orthosilicate 0.95
    tributyl phosphate 0.73
    diacetone alcohol 5.37
    N,N-dimethylaniline 1.28
    acrylonitrile 2.35
    aniline 1.44
    1,3-propanediol 12.19
    bromobenzene 0.46
    dibromomethane 1.57
    1,1,2,2-tetrachloroethane 3.59
    2-methyl-cyclohexyl acetate 1.4
    tetrabutyl urea 1.23
    diisobutyl methanol 0.36
    2-phenylethanol 2.92
    styrene 0.31
    dioctyl adipate 1.2
    dimethyl sulfate 9.26
    ethyl butyrate 1.28
    methyl lactate 6.99
    butyl lactate 3.59
    diethyl carbonate 0.88
    propanediol butyl ether 8.99
    triethyl orthoformate 1.49
    p-tert-butyltoluene 0.24
    methyl 4-tert-butylbenzoate 4.07
    morpholine 20.08
    tert-butylamine 0.45
    n-dodecanol 0.28
    dimethoxymethane 28.38
    ethylene carbonate 3.58
    cyrene 9.34
    2-ethoxyethyl acetate 6.71
    2-ethylhexyl acetate 1.15
    1,2,4-trichlorobenzene 1.01
    4-methylpyridine 3.02
    dibutyl ether 0.57
    2,6-dimethyl-4-heptanol 0.36
    DEF 4.98
    dimethyl isosorbide 10.63
    tetrachloroethylene 3.0
    eugenol 5.44
    triacetin 4.34
    span 80 5.72
    1,4-butanediol 3.5
    1,1-dichloroethane 1.03
    2-methyl-1-pentanol 0.96
    methyl formate 10.46
    2-methyl-1-butanol 1.22
    n-decane 0.04
    butyronitrile 1.09
    3,7-dimethyl-1-octanol 0.65
    1-chlorooctane 0.23
    1-chlorotetradecane 0.06
    n-nonane 0.03
    undecane 0.02
    tert-butylcyclohexane 0.03
    cyclooctane 0.03
    cyclopentanol 2.37
    tetrahydropyran 4.27
    tert-amyl methyl ether 1.04
    2,5,8-trioxanonane 10.55
    1-hexene 0.19
    2-isopropoxyethanol 6.16
    2,2,2-trifluoroethanol 5.65
    methyl butyrate 1.98

    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