Butyrospermol

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  • Identifiers

    CAS number
    472-28-6

    Molecular formula
    C30H50O

    SMILES
    C[C@H](CCC=C(C)C)[C@@H]1CC[C@]2([C@]1(CC[C@H]3C2=CC[C@@H]4[C@@]3(CC[C@@H](C4(C)C)O)C)C)C

    Safety labels

  • Odor profile

    Fragrance
    Woody 88.63%
    Sandalwood 51.91%
    Amber 49.6%
    Dry 46.18%
    Sweet 45.8%
    Balsamic 39.33%
    Cedar 38.97%
    Spicy 36.5%
    Vetiver 34.99%
    Musk 32.64%

     

    Flavor
    Woody 74.77%
    Wood 46.06%
    Sweet 43.08%
    Pine 39.88%
    Balsam 39.15%
    Camphor 33.49%
    Dry 31.91%
    Spice 30.71%
    Balsamic 30.16%
    Fresh 29.75%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    9.2

    pKa est.
    7.43 (neutral)

    Molecular weight
    426.7 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    483°C

    Flash point

    • 215.39 ˚C est.

  • Synonyms

    • Butyrospermol
    • (-)-Butyrospermol
    • 472-28-6
    • UNII-6SF0L0FL42
    • 6SF0L0FL42
    • Lanosta-7,24-dien-3-ol, (3beta,13alpha,14beta,17alpha)-
    • .DELTA.7-BUTYROSPERMOL
    • (3S,5R,10R,13S,14S)-17-((R)-1,5-Dimethyl-hex-4-enyl)-4,4,10,13,14-pentamethyl-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta(a)phenanthren-3-ol
    • (3S,5R,9R,10R,13S,14S,17S)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
    • 5.ALPHA.-EUPHA-7,24-DIEN-3.BETA.-OL
    • 9.ALPHA.-EUPHA-7,24-DIEN-3.BETA.-OL
    • 13.ALPHA.,14.BETA.,17.BETA.H-LANOSTA-7,24-DIEN-3.BETA.-OL
    • LANOSTA-7,24-DIEN-3-OL, (3.BETA.,13.ALPHA.,14.BETA.,17.ALPHA.)-
    • (3S,5R,9R,10R,13S,14S,17S)-4,4,10,13,14-pentamethyl-17-((2R)-6-methylhept-5-en-2-yl)-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta(a)phenanthren-3-ol
    • RefChem:122375
    • DELTA7-BUTYROSPERMOL
    • 5ALPHA-EUPHA-7,24-DIEN-3BETA-OL
    • 9ALPHA-EUPHA-7,24-DIEN-3BETA-OL
    • 13ALPHA,14BETA,17BETAH-LANOSTA-7,24-DIEN-3BETA-OL
    • 4,4,10,13,14-pentamethyl-17-(6-methylhept-5-en-2-yl)-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta(a)phenanthren-3-ol
    • 4,4,10,13,14-pentamethyl-17-(6-methylhept-5-en-2-yl)-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
    • Eupha-7,24-dien-3 beta-ol
    • (3S,5R,10R,13S,14S)-4,4,10,13,14-pentamethyl-17-[(2R)-6-methylhept-5-en-2-yl]-2,3,5,6,9,11,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-ol
    • orb1680224
    • SCHEMBL29573635
    • AKOS040763536
    • DA-51486
    • HY-124045
    • Q27265440
    • 472-28-6

  • Applications

    Butyrospermol, a plant-derived triterpene alcohol, is used as a cosmetic emollient and conditioning agent in skin and hair care formulations; it can act as a fragrance ingredient or fixative in perfumery; it may serve as a waxy component or thickener in cosmetic formulations; in industrial manufacturing it serves as a chemical intermediate for the synthesis of other terpenoids; and it may be evaluated as a natural additive for polymers/plastics or coatings.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 6.42
    methanol 1.62
    isopropanol 6.13
    water 0.02
    ethyl acetate 12.76
    n-propanol 10.22
    acetone 10.31
    n-butanol 13.97
    acetonitrile 1.66
    DMF 13.27
    toluene 30.21
    isobutanol 9.31
    1,4-dioxane 27.11
    methyl acetate 6.82
    THF 45.8
    2-butanone 14.1
    n-pentanol 10.44
    sec-butanol 5.96
    n-hexane 1.99
    ethylene glycol 0.32
    NMP 23.56
    cyclohexane 2.25
    DMSO 4.16
    n-butyl acetate 18.15
    n-octanol 9.77
    chloroform 34.38
    n-propyl acetate 10.9
    acetic acid 3.97
    dichloromethane 17.51
    cyclohexanone 27.39
    propylene glycol 0.94
    isopropyl acetate 18.16
    DMAc 27.44
    2-ethoxyethanol 12.09
    isopentanol 15.31
    n-heptane 2.43
    ethyl formate 3.31
    1,2-dichloroethane 11.48
    n-hexanol 15.19
    2-methoxyethanol 11.48
    isobutyl acetate 14.6
    tetrachloromethane 7.88
    n-pentyl acetate 25.82
    transcutol 63.74
    n-heptanol 16.04
    ethylbenzene 13.33
    MIBK 21.03
    2-propoxyethanol 35.58
    tert-butanol 6.84
    MTBE 13.67
    2-butoxyethanol 33.39
    propionic acid 4.15
    o-xylene 16.47
    formic acid 0.93
    diethyl ether 17.46
    m-xylene 23.97
    p-xylene 14.08
    chlorobenzene 19.54
    dimethyl carbonate 6.38
    n-octane 0.78
    formamide 1.41
    cyclopentanone 26.7
    2-pentanone 18.78
    anisole 26.03
    cyclopentyl methyl ether 28.28
    gamma-butyrolactone 17.65
    1-methoxy-2-propanol 17.88
    pyridine 26.08
    3-pentanone 16.19
    furfural 16.18
    n-dodecane 0.38
    diethylene glycol 9.13
    diisopropyl ether 9.56
    tert-amyl alcohol 6.58
    acetylacetone 20.65
    n-hexadecane 0.48
    acetophenone 20.27
    methyl propionate 12.57
    isopentyl acetate 26.51
    trichloroethylene 27.78
    n-nonanol 12.81
    cyclohexanol 10.09
    benzyl alcohol 13.44
    2-ethylhexanol 13.37
    isooctanol 15.56
    dipropyl ether 20.58
    1,2-dichlorobenzene 18.55
    ethyl lactate 6.07
    propylene carbonate 10.93
    n-methylformamide 3.27
    2-pentanol 9.84
    n-pentane 2.22
    1-propoxy-2-propanol 31.62
    1-methoxy-2-propyl acetate 36.18
    2-(2-methoxypropoxy) propanol 28.75
    mesitylene 14.34
    ε-caprolactone 25.14
    p-cymene 12.21
    epichlorohydrin 22.68
    1,1,1-trichloroethane 16.24
    2-aminoethanol 1.8
    morpholine-4-carbaldehyde 31.75
    sulfolane 17.45
    2,2,4-trimethylpentane 1.68
    2-methyltetrahydrofuran 22.76
    n-hexyl acetate 25.77
    isooctane 1.87
    2-(2-butoxyethoxy)ethanol 37.58
    sec-butyl acetate 12.85
    tert-butyl acetate 25.23
    decalin 2.32
    glycerin 1.96
    diglyme 57.65
    acrylic acid 3.01
    isopropyl myristate 11.15
    n-butyric acid 11.78
    acetyl acetate 10.44
    di(2-ethylhexyl) phthalate 14.37
    ethyl propionate 12.06
    nitromethane 5.37
    1,2-diethoxyethane 25.95
    benzonitrile 10.69
    trioctyl phosphate 9.35
    1-bromopropane 10.78
    gamma-valerolactone 42.67
    n-decanol 7.87
    triethyl phosphate 11.48
    4-methyl-2-pentanol 10.37
    propionitrile 4.86
    vinylene carbonate 11.13
    1,1,2-trichlorotrifluoroethane 13.93
    DMS 14.91
    cumene 10.36
    2-octanol 8.85
    2-hexanone 14.97
    octyl acetate 12.64
    limonene 12.73
    1,2-dimethoxyethane 24.42
    ethyl orthosilicate 14.62
    tributyl phosphate 8.55
    diacetone alcohol 19.88
    N,N-dimethylaniline 22.23
    acrylonitrile 4.15
    aniline 18.52
    1,3-propanediol 5.37
    bromobenzene 23.94
    dibromomethane 13.36
    1,1,2,2-tetrachloroethane 24.2
    2-methyl-cyclohexyl acetate 21.36
    tetrabutyl urea 13.66
    diisobutyl methanol 10.49
    2-phenylethanol 23.34
    styrene 13.8
    dioctyl adipate 16.23
    dimethyl sulfate 9.01
    ethyl butyrate 16.81
    methyl lactate 5.89
    butyl lactate 18.57
    diethyl carbonate 9.98
    propanediol butyl ether 16.92
    triethyl orthoformate 20.83
    p-tert-butyltoluene 12.85
    methyl 4-tert-butylbenzoate 35.41
    morpholine 29.6
    tert-butylamine 5.94
    n-dodecanol 4.76
    dimethoxymethane 21.44
    ethylene carbonate 9.63
    cyrene 21.76
    2-ethoxyethyl acetate 34.51
    2-ethylhexyl acetate 23.26
    1,2,4-trichlorobenzene 24.69
    4-methylpyridine 27.77
    dibutyl ether 10.81
    2,6-dimethyl-4-heptanol 10.49
    DEF 18.43
    dimethyl isosorbide 48.13
    tetrachloroethylene 16.32
    eugenol 33.09
    triacetin 25.37
    span 80 24.36
    1,4-butanediol 2.15
    1,1-dichloroethane 12.09
    2-methyl-1-pentanol 11.93
    methyl formate 2.27
    2-methyl-1-butanol 12.46
    n-decane 1.13
    butyronitrile 6.97
    3,7-dimethyl-1-octanol 11.62
    1-chlorooctane 5.75
    1-chlorotetradecane 1.55
    n-nonane 0.92
    undecane 0.61
    tert-butylcyclohexane 2.5
    cyclooctane 1.4
    cyclopentanol 7.44
    tetrahydropyran 27.4
    tert-amyl methyl ether 12.25
    2,5,8-trioxanonane 38.62
    1-hexene 6.14
    2-isopropoxyethanol 13.36
    2,2,2-trifluoroethanol 2.13
    methyl butyrate 12.06

    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