(1S,4aS,4bR,7R,8aS,10aS)-Tetradecahydro-4b,7,8a,10a-tetramethyl-2-(1-methylethylidene)-7-(4-methyl-3-penten-1-yl)-1-phenanthrenepropanol

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  • Identifiers

    CAS number
    211183-83-4

    Molecular formula
    C30H52O

    SMILES
    CC(=CCC[C@@]1(CC[C@@]2([C@H]3CCC(=C(C)C)[C@H]([C@@]3(CC[C@]2(C1)C)C)CCCO)C)C)C

    Safety labels

  • Odor profile

    Fragrance
    Woody 85.28%
    Amber 50.95%
    Sandalwood 50.81%
    Sweet 44.44%
    Dry 43.21%
    Waxy 41.76%
    Balsamic 38.8%
    Powdery 37.89%
    Musk 36.41%
    Floral 33.29%

     

    Flavor
    Woody 63.1%
    Sweet 44.99%
    Wood 39.41%
    Balsam 36.38%
    Dry 30.39%
    Floral 30.31%
    Amber 29.4%
    Fresh 28.29%
    Balsamic 28.08%
    Mild 26.96%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    9.8

    pKa est.
    8.52 (weak base)

    Molecular weight
    428.7 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    516°C

    Flash point

    • 221.58 ˚C est.

  • Synonyms

    • (1S,4aS,4bR,7R,8aS,10aS)-Tetradecahydro-4b,7,8a,10a-tetramethyl-2-(1-methylethylidene)-7-(4-methyl-3-penten-1-yl)-1-phenanthrenepropanol
    • 211183-83-4
    • 3-[(1S,4As,4bR,7R,8aS,10aS)-4b,7,8a,10a-tetramethyl-7-(4-methylpent-3-enyl)-2-propan-2-ylidene-3,4,4a,5,6,8,9,10-octahydro-1H-phenanthren-1-yl]propan-1-ol
    • 3-((1S,4aS,4bR,7R,8aS,10aS)-4b,7,8a,10a-tetramethyl-7-(4-methylpent-3-enyl)-2-propan-2-ylidene-3,4,4a,5,6,8,9,10-octahydro-1H-phenanthren-1-yl)propan-1-ol
    • RefChem:68435
    • SCHEMBL29934386
    • DTXSID801101596
    • 211183-83-4

  • Applications

    CAS 211183-83-4, (1S,4aS,4bR,7R,8aS,10aS)-Tetradecahydro-4b,7,8a,10a-tetramethyl-2-(1-methylethylidene)-7-(4-methyl-3-penten-1-yl)-1-phenanthrenepropanol, is used as a fragrance ingredient and odorant in perfumery and cosmetics, with potential to act as a fixative in some formulations. It can also serve as an intermediate in the synthesis of aroma compounds and related materials, and may be incorporated into household products to contribute to scent profiles. In coatings and inks used in industrial settings, it may function as a fragrance additive to modify odor characteristics, while usage is subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 12.12
    methanol 3.46
    isopropanol 13.52
    water 0.02
    ethyl acetate 36.79
    n-propanol 22.02
    acetone 27.73
    n-butanol 26.82
    acetonitrile 5.27
    DMF 47.24
    toluene 67.05
    isobutanol 21.33
    1,4-dioxane 70.57
    methyl acetate 19.92
    THF 140.51
    2-butanone 38.83
    n-pentanol 19.96
    sec-butanol 16.57
    n-hexane 4.39
    ethylene glycol 0.71
    NMP 71.84
    cyclohexane 6.04
    DMSO 14.58
    n-butyl acetate 43.62
    n-octanol 21.06
    chloroform 94.24
    n-propyl acetate 29.15
    acetic acid 9.64
    dichloromethane 49.39
    cyclohexanone 72.6
    propylene glycol 2.59
    isopropyl acetate 45.44
    DMAc 77.47
    2-ethoxyethanol 27.98
    isopentanol 28.33
    n-heptane 5.01
    ethyl formate 9.2
    1,2-dichloroethane 33.63
    n-hexanol 29.26
    2-methoxyethanol 26.34
    isobutyl acetate 34.73
    tetrachloromethane 17.66
    n-pentyl acetate 57.05
    transcutol 151.26
    n-heptanol 29.68
    ethylbenzene 27.52
    MIBK 47.74
    2-propoxyethanol 70.97
    tert-butanol 17.19
    MTBE 39.72
    2-butoxyethanol 65.34
    propionic acid 11.46
    o-xylene 35.74
    formic acid 1.67
    diethyl ether 50.13
    m-xylene 49.21
    p-xylene 26.64
    chlorobenzene 45.4
    dimethyl carbonate 19.67
    n-octane 1.66
    formamide 2.69
    cyclopentanone 79.38
    2-pentanone 48.08
    anisole 52.18
    cyclopentyl methyl ether 79.39
    gamma-butyrolactone 56.13
    1-methoxy-2-propanol 45.06
    pyridine 61.98
    3-pentanone 40.97
    furfural 44.66
    n-dodecane 0.66
    diethylene glycol 18.93
    diisopropyl ether 22.18
    tert-amyl alcohol 19.06
    acetylacetone 55.14
    n-hexadecane 0.84
    acetophenone 42.75
    methyl propionate 36.15
    isopentyl acetate 56.78
    trichloroethylene 82.75
    n-nonanol 24.23
    cyclohexanol 25.61
    benzyl alcohol 28.71
    2-ethylhexanol 26.24
    isooctanol 29.08
    dipropyl ether 47.09
    1,2-dichlorobenzene 44.29
    ethyl lactate 17.0
    propylene carbonate 32.99
    n-methylformamide 9.57
    2-pentanol 21.71
    n-pentane 5.12
    1-propoxy-2-propanol 67.26
    1-methoxy-2-propyl acetate 84.25
    2-(2-methoxypropoxy) propanol 56.33
    mesitylene 27.19
    ε-caprolactone 68.04
    p-cymene 23.43
    epichlorohydrin 71.54
    1,1,1-trichloroethane 47.35
    2-aminoethanol 3.87
    morpholine-4-carbaldehyde 87.75
    sulfolane 61.82
    2,2,4-trimethylpentane 3.83
    2-methyltetrahydrofuran 71.79
    n-hexyl acetate 60.56
    isooctane 3.52
    2-(2-butoxyethoxy)ethanol 74.67
    sec-butyl acetate 30.79
    tert-butyl acetate 61.45
    decalin 4.72
    glycerin 5.05
    diglyme 133.64
    acrylic acid 8.47
    isopropyl myristate 22.69
    n-butyric acid 26.75
    acetyl acetate 28.64
    di(2-ethylhexyl) phthalate 27.29
    ethyl propionate 31.09
    nitromethane 16.14
    1,2-diethoxyethane 62.79
    benzonitrile 24.91
    trioctyl phosphate 18.85
    1-bromopropane 29.3
    gamma-valerolactone 116.02
    n-decanol 14.5
    triethyl phosphate 24.93
    4-methyl-2-pentanol 20.21
    propionitrile 12.71
    vinylene carbonate 31.28
    1,1,2-trichlorotrifluoroethane 46.64
    DMS 39.58
    cumene 19.47
    2-octanol 18.47
    2-hexanone 34.25
    octyl acetate 26.89
    limonene 27.74
    1,2-dimethoxyethane 59.63
    ethyl orthosilicate 29.43
    tributyl phosphate 17.32
    diacetone alcohol 49.15
    N,N-dimethylaniline 42.49
    acrylonitrile 11.17
    aniline 41.8
    1,3-propanediol 10.89
    bromobenzene 56.28
    dibromomethane 36.64
    1,1,2,2-tetrachloroethane 73.05
    2-methyl-cyclohexyl acetate 45.11
    tetrabutyl urea 27.71
    diisobutyl methanol 19.63
    2-phenylethanol 43.88
    styrene 28.13
    dioctyl adipate 33.48
    dimethyl sulfate 30.51
    ethyl butyrate 39.73
    methyl lactate 17.0
    butyl lactate 44.73
    diethyl carbonate 22.78
    propanediol butyl ether 41.75
    triethyl orthoformate 44.85
    p-tert-butyltoluene 24.16
    methyl 4-tert-butylbenzoate 71.53
    morpholine 79.63
    tert-butylamine 14.21
    n-dodecanol 8.62
    dimethoxymethane 62.29
    ethylene carbonate 27.7
    cyrene 47.93
    2-ethoxyethyl acetate 78.32
    2-ethylhexyl acetate 49.33
    1,2,4-trichlorobenzene 58.31
    4-methylpyridine 66.23
    dibutyl ether 25.16
    2,6-dimethyl-4-heptanol 19.63
    DEF 50.82
    dimethyl isosorbide 97.64
    tetrachloroethylene 43.92
    eugenol 61.28
    triacetin 64.52
    span 80 51.41
    1,4-butanediol 4.54
    1,1-dichloroethane 35.2
    2-methyl-1-pentanol 23.45
    methyl formate 6.93
    2-methyl-1-butanol 27.74
    n-decane 2.19
    butyronitrile 16.45
    3,7-dimethyl-1-octanol 23.64
    1-chlorooctane 13.48
    1-chlorotetradecane 3.0
    n-nonane 1.94
    undecane 1.1
    tert-butylcyclohexane 4.89
    cyclooctane 3.34
    cyclopentanol 21.8
    tetrahydropyran 78.1
    tert-amyl methyl ether 36.44
    2,5,8-trioxanonane 75.79
    1-hexene 14.03
    2-isopropoxyethanol 29.78
    2,2,2-trifluoroethanol 5.34
    methyl butyrate 32.22

    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