Blumenol B

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  • Identifiers

    CAS number
    36151-01-6

    Molecular formula
    C13H22O3

    SMILES
    CC1=CC(=O)CC([C@]1(CCC(C)O)O)(C)C

    Safety labels

  • Odor profile

    Fragrance
    Woody 70.53%
    Sweet 51.73%
    Fruity 49.45%
    Floral 49.25%
    Earthy 32.98%
    Mint 32.2%
    Berry 31.99%
    Dry 30.79%
    Tobacco 30.06%
    Camphoreous 28.13%

     

    Flavor
    Fruity 65.53%
    Sweet 44.96%
    Woody 33.42%
    Berry 31.01%
    Herbal 28.18%
    Tropical 26.68%
    Minty 25.68%
    Spicy 25.19%
    Musty 23.81%
    Caramel 23.69%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    0.8

    pKa est.
    8.78 (weak base)

    Molecular weight
    226.31 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    395°C

    Flash point

    • 154.39 ˚C est.

  • Synonyms

    • 36151-01-6
    • RefChem:1080049
    • (6R,9RS)-7,8-dihydro-6,9-dihydroxy-9-apo-epsilonn-caroten-3-one
    • (4S)-4-hydroxy-4-((3R)-3-hydroxybutyl)-3,5,5-trimethylcyclohex-2-en-1-one
    • Blumenol B
    • Dihydrovomifoliol
    • (4S)-4-Hydroxy-4-[(3R)-3-hydroxybutyl]-3,5,5-trimethyl-2-cyclohexen-1-one; Blumenol B
    • G88945
    • 36151-01-6

  • Applications

    Blumenol B, CAS 36151-01-6, is a natural terpenoid compound used as a fragrance ingredient and aroma material; it is applied in perfumery and fragrance; it is also used in cosmetics and personal care as an odor component, and in household products as a scent additive; moreover, Blumenol B may be considered as a building block or intermediate in organic synthesis related to the fragrance industry.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 333.63
    methanol 684.4
    isopropanol 227.37
    water 13.34
    ethyl acetate 94.15
    n-propanol 196.73
    acetone 182.3
    n-butanol 155.54
    acetonitrile 136.88
    DMF 558.43
    toluene 62.04
    isobutanol 120.14
    1,4-dioxane 446.94
    methyl acetate 99.63
    THF 609.47
    2-butanone 104.87
    n-pentanol 102.42
    sec-butanol 108.42
    n-hexane 3.24
    ethylene glycol 110.54
    NMP 273.57
    cyclohexane 6.74
    DMSO 322.23
    n-butyl acetate 64.17
    n-octanol 64.26
    chloroform 168.16
    n-propyl acetate 57.31
    acetic acid 184.63
    dichloromethane 173.86
    cyclohexanone 168.93
    propylene glycol 125.57
    isopropyl acetate 67.98
    DMAc 287.57
    2-ethoxyethanol 201.63
    isopentanol 110.84
    n-heptane 4.22
    ethyl formate 107.24
    1,2-dichloroethane 81.82
    n-hexanol 120.37
    2-methoxyethanol 454.71
    isobutyl acetate 47.01
    tetrachloromethane 23.43
    n-pentyl acetate 52.5
    transcutol 272.16
    n-heptanol 69.61
    ethylbenzene 35.72
    MIBK 72.31
    2-propoxyethanol 265.59
    tert-butanol 256.9
    MTBE 81.42
    2-butoxyethanol 126.31
    propionic acid 99.29
    o-xylene 44.46
    formic acid 210.36
    diethyl ether 80.16
    m-xylene 53.36
    p-xylene 50.63
    chlorobenzene 62.06
    dimethyl carbonate 60.92
    n-octane 3.09
    formamide 253.14
    cyclopentanone 243.74
    2-pentanone 93.47
    anisole 102.94
    cyclopentyl methyl ether 131.77
    gamma-butyrolactone 275.78
    1-methoxy-2-propanol 294.05
    pyridine 166.19
    3-pentanone 58.04
    furfural 243.13
    n-dodecane 3.03
    diethylene glycol 251.52
    diisopropyl ether 23.13
    tert-amyl alcohol 119.46
    acetylacetone 144.24
    n-hexadecane 3.45
    acetophenone 90.27
    methyl propionate 87.19
    isopentyl acetate 68.31
    trichloroethylene 152.03
    n-nonanol 57.68
    cyclohexanol 98.05
    benzyl alcohol 102.44
    2-ethylhexanol 52.2
    isooctanol 51.18
    dipropyl ether 47.59
    1,2-dichlorobenzene 56.59
    ethyl lactate 53.08
    propylene carbonate 141.7
    n-methylformamide 263.42
    2-pentanol 72.38
    n-pentane 3.4
    1-propoxy-2-propanol 146.39
    1-methoxy-2-propyl acetate 101.22
    2-(2-methoxypropoxy) propanol 99.71
    mesitylene 31.74
    ε-caprolactone 154.53
    p-cymene 24.78
    epichlorohydrin 255.12
    1,1,1-trichloroethane 61.7
    2-aminoethanol 205.68
    morpholine-4-carbaldehyde 368.51
    sulfolane 267.49
    2,2,4-trimethylpentane 3.58
    2-methyltetrahydrofuran 207.93
    n-hexyl acetate 79.82
    isooctane 3.55
    2-(2-butoxyethoxy)ethanol 135.29
    sec-butyl acetate 44.85
    tert-butyl acetate 83.14
    decalin 6.04
    glycerin 187.64
    diglyme 226.01
    acrylic acid 92.45
    isopropyl myristate 33.44
    n-butyric acid 123.73
    acetyl acetate 78.41
    di(2-ethylhexyl) phthalate 42.74
    ethyl propionate 55.6
    nitromethane 251.42
    1,2-diethoxyethane 88.28
    benzonitrile 100.36
    trioctyl phosphate 33.3
    1-bromopropane 41.19
    gamma-valerolactone 367.19
    n-decanol 42.7
    triethyl phosphate 36.27
    4-methyl-2-pentanol 51.49
    propionitrile 95.76
    vinylene carbonate 142.24
    1,1,2-trichlorotrifluoroethane 160.56
    DMS 60.81
    cumene 28.82
    2-octanol 44.44
    2-hexanone 66.03
    octyl acetate 45.67
    limonene 32.89
    1,2-dimethoxyethane 314.69
    ethyl orthosilicate 36.9
    tributyl phosphate 33.06
    diacetone alcohol 128.88
    N,N-dimethylaniline 77.73
    acrylonitrile 118.97
    aniline 94.83
    1,3-propanediol 250.42
    bromobenzene 51.2
    dibromomethane 91.44
    1,1,2,2-tetrachloroethane 124.09
    2-methyl-cyclohexyl acetate 59.83
    tetrabutyl urea 49.45
    diisobutyl methanol 35.75
    2-phenylethanol 103.47
    styrene 39.22
    dioctyl adipate 48.1
    dimethyl sulfate 94.43
    ethyl butyrate 52.44
    methyl lactate 80.65
    butyl lactate 57.18
    diethyl carbonate 38.74
    propanediol butyl ether 114.5
    triethyl orthoformate 45.24
    p-tert-butyltoluene 26.11
    methyl 4-tert-butylbenzoate 82.19
    morpholine 437.79
    tert-butylamine 110.9
    n-dodecanol 30.76
    dimethoxymethane 310.44
    ethylene carbonate 113.47
    cyrene 127.66
    2-ethoxyethyl acetate 73.31
    2-ethylhexyl acetate 49.31
    1,2,4-trichlorobenzene 71.29
    4-methylpyridine 161.28
    dibutyl ether 39.94
    2,6-dimethyl-4-heptanol 35.75
    DEF 110.34
    dimethyl isosorbide 192.46
    tetrachloroethylene 77.08
    eugenol 92.33
    triacetin 70.76
    span 80 89.86
    1,4-butanediol 93.46
    1,1-dichloroethane 73.22
    2-methyl-1-pentanol 75.45
    methyl formate 205.5
    2-methyl-1-butanol 86.47
    n-decane 5.44
    butyronitrile 112.42
    3,7-dimethyl-1-octanol 53.37
    1-chlorooctane 25.21
    1-chlorotetradecane 9.62
    n-nonane 4.68
    undecane 3.97
    tert-butylcyclohexane 6.13
    cyclooctane 2.92
    cyclopentanol 142.18
    tetrahydropyran 210.94
    tert-amyl methyl ether 54.4
    2,5,8-trioxanonane 168.26
    1-hexene 17.13
    2-isopropoxyethanol 119.33
    2,2,2-trifluoroethanol 75.15
    methyl butyrate 75.32

    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