Selina-1,3,5(11)-trien-8-one

Overview IFRA Botanical Request a quote

  • Identifiers

    Molecular formula
    C15H20O

    SMILES
    CC1=CC=C[C@]2(C1=C[C@@H](C(=O)C2)C(C)C)C

  • Odor profile

    Fruity 59.31%
    Woody 54.15%
    Spicy 44.35%
    Herbal 37.6%
    Mint 31.24%
    Fresh 30.73%
    Tobacco 28.83%
    Citrus 24.99%
    Berry 24.8%
    Dry 24.42%

    Scent© AI

  • Properties

    XLogP3-AA
    3.3

    pKa est.
    8.09 (weak base)

    Molecular weight
    216.32 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    305°C

    Flash point est.
    133.16 ˚C

  • Synonyms

    • ZJWXBZANERDOCV-IUODEOHRSA-N
    • Selina-1,3,5(11)-trien-8-one

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 53.9
    methanol 61.16
    isopropanol 44.34
    water 0.13
    ethyl acetate 106.96
    n-propanol 56.39
    acetone 109.4
    n-butanol 65.88
    acetonitrile 88.14
    DMF 219.95
    toluene 264.22
    isobutanol 47.3
    1,4-dioxane 340.98
    methyl acetate 112.27
    THF 459.32
    2-butanone 128.85
    n-pentanol 51.09
    sec-butanol 45.21
    n-hexane 17.88
    ethylene glycol 5.77
    NMP 292.97
    cyclohexane 53.41
    DMSO 65.14
    n-butyl acetate 138.04
    n-octanol 52.47
    chloroform 527.22
    n-propyl acetate 83.4
    acetic acid 53.75
    dichloromethane 413.94
    cyclohexanone 302.09
    propylene glycol 11.1
    isopropyl acetate 76.98
    DMAc 169.08
    2-ethoxyethanol 48.4
    isopentanol 61.79
    n-heptane 20.6
    ethyl formate 75.35
    1,2-dichloroethane 194.91
    n-hexanol 111.85
    2-methoxyethanol 74.97
    isobutyl acetate 73.07
    tetrachloromethane 68.42
    n-pentyl acetate 95.07
    transcutol 248.19
    n-heptanol 56.95
    ethylbenzene 105.73
    MIBK 84.46
    2-propoxyethanol 135.02
    tert-butanol 57.36
    MTBE 77.82
    2-butoxyethanol 77.13
    propionic acid 49.2
    o-xylene 119.72
    formic acid 12.58
    diethyl ether 96.77
    m-xylene 160.43
    p-xylene 128.65
    chlorobenzene 229.48
    dimethyl carbonate 51.0
    n-octane 8.8
    formamide 23.84
    cyclopentanone 322.79
    2-pentanone 111.73
    anisole 145.08
    cyclopentyl methyl ether 184.25
    gamma-butyrolactone 272.69
    1-methoxy-2-propanol 68.13
    pyridine 340.47
    3-pentanone 97.38
    furfural 235.14
    n-dodecane 7.86
    diethylene glycol 66.4
    diisopropyl ether 39.45
    tert-amyl alcohol 50.2
    acetylacetone 117.39
    n-hexadecane 9.46
    acetophenone 134.1
    methyl propionate 88.24
    isopentyl acetate 132.81
    trichloroethylene 448.6
    n-nonanol 50.68
    cyclohexanol 99.87
    benzyl alcohol 104.65
    2-ethylhexanol 80.96
    isooctanol 47.34
    dipropyl ether 80.53
    1,2-dichlorobenzene 186.53
    ethyl lactate 41.46
    propylene carbonate 159.8
    n-methylformamide 64.05
    2-pentanol 44.94
    n-pentane 16.99
    1-propoxy-2-propanol 105.3
    1-methoxy-2-propyl acetate 133.08
    2-(2-methoxypropoxy) propanol 96.91
    mesitylene 90.12
    ε-caprolactone 224.88
    p-cymene 73.19
    epichlorohydrin 286.72
    1,1,1-trichloroethane 208.95
    2-aminoethanol 17.09
    morpholine-4-carbaldehyde 246.37
    sulfolane 214.84
    2,2,4-trimethylpentane 10.79
    2-methyltetrahydrofuran 271.5
    n-hexyl acetate 134.02
    isooctane 9.96
    2-(2-butoxyethoxy)ethanol 113.58
    sec-butyl acetate 70.13
    tert-butyl acetate 93.28
    decalin 27.52
    glycerin 17.23
    diglyme 188.97
    acrylic acid 44.59
    isopropyl myristate 61.07
    n-butyric acid 84.55
    acetyl acetate 83.25
    di(2-ethylhexyl) phthalate 69.84
    ethyl propionate 78.49
    nitromethane 105.06
    1,2-diethoxyethane 119.31
    benzonitrile 182.2
    trioctyl phosphate 45.53
    1-bromopropane 139.36
    gamma-valerolactone 328.62
    n-decanol 39.96
    triethyl phosphate 60.97
    4-methyl-2-pentanol 38.09
    propionitrile 95.35
    vinylene carbonate 162.57
    1,1,2-trichlorotrifluoroethane 117.07
    DMS 117.17
    cumene 68.83
    2-octanol 39.68
    2-hexanone 95.68
    octyl acetate 74.74
    limonene 91.72
    1,2-dimethoxyethane 136.89
    ethyl orthosilicate 58.79
    tributyl phosphate 54.47
    diacetone alcohol 89.47
    N,N-dimethylaniline 103.52
    acrylonitrile 108.74
    aniline 159.23
    1,3-propanediol 32.92
    bromobenzene 270.15
    dibromomethane 275.96
    1,1,2,2-tetrachloroethane 289.4
    2-methyl-cyclohexyl acetate 115.19
    tetrabutyl urea 69.66
    diisobutyl methanol 45.17
    2-phenylethanol 151.0
    styrene 121.78
    dioctyl adipate 84.81
    dimethyl sulfate 64.12
    ethyl butyrate 101.39
    methyl lactate 38.23
    butyl lactate 68.57
    diethyl carbonate 75.36
    propanediol butyl ether 64.16
    triethyl orthoformate 78.86
    p-tert-butyltoluene 69.41
    methyl 4-tert-butylbenzoate 117.75
    morpholine 314.46
    tert-butylamine 46.34
    n-dodecanol 32.17
    dimethoxymethane 136.47
    ethylene carbonate 125.34
    cyrene 110.24
    2-ethoxyethyl acetate 120.9
    2-ethylhexyl acetate 117.33
    1,2,4-trichlorobenzene 218.12
    4-methylpyridine 332.37
    dibutyl ether 66.41
    2,6-dimethyl-4-heptanol 45.17
    DEF 123.14
    dimethyl isosorbide 211.4
    tetrachloroethylene 190.26
    eugenol 105.91
    triacetin 119.94
    span 80 93.81
    1,4-butanediol 15.95
    1,1-dichloroethane 194.15
    2-methyl-1-pentanol 61.97
    methyl formate 63.13
    2-methyl-1-butanol 60.1
    n-decane 13.13
    butyronitrile 110.68
    3,7-dimethyl-1-octanol 59.56
    1-chlorooctane 51.46
    1-chlorotetradecane 23.84
    n-nonane 11.72
    undecane 9.86
    tert-butylcyclohexane 22.67
    cyclooctane 18.44
    cyclopentanol 91.39
    tetrahydropyran 328.5
    tert-amyl methyl ether 63.72
    2,5,8-trioxanonane 142.11
    1-hexene 57.57
    2-isopropoxyethanol 49.37
    2,2,2-trifluoroethanol 21.5
    methyl butyrate 98.41

    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

Botanical

Name CAS Botanical Proportion
Eugenia uniflora leaf (Brazil) 1 Eugenia uniflora L. (E. michelii Lam., E. pitanga (Berg), fam. Myrtaceae 48.52%