Isopimara-7,15-Dien-3-One

  • Identifiers

    CAS number
    7715-48-2

    Molecular formula
    C20H30O

    SMILES
    C[C@@]1(CC[C@H]2C(=CC[C@@H]3[C@@]2(CCC(=O)C3(C)C)C)C1)C=C

    Retention indicies (RI)

    • DB5: 2279.0
  • Odor profile

    Woody 75.51%
    Sweet 47.14%
    Dry 42.87%
    Amber 42.66%
    Spicy 39.21%
    Cedar 39.01%
    Camphoreous 37.44%
    Tobacco 37.33%
    Fresh 36.55%
    Green 36.31%

    Scent© AI

  • Properties

    XLogP3-AA
    4.9

    Molecular weight
    286.5 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    398°C

    Flash point est.
    179.22 ˚C

  • Synonyms

    • isopimara-7,15-dien-3-one
    • 7715-48-2
    • CHEMBL1097037
    • 13BETA-METHYL-13-VINYL-PODOCARP-7-EN-3-ONE
    • (4aR,4bS,7S,10aR)-7-ethenyl-1,1,4a,7-tetramethyl-3,4,4b,5,6,8,10,10a-octahydrophenanthren-2-one
  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 72.76
    methanol 41.07
    isopropanol 81.91
    water 0.1
    ethyl acetate 151.82
    n-propanol 94.27
    acetone 115.43
    n-butanol 111.44
    acetonitrile 64.02
    DMF 248.1
    toluene 492.14
    isobutanol 79.82
    1,4-dioxane 316.06
    methyl acetate 96.76
    THF 580.2
    2-butanone 141.88
    n-pentanol 48.05
    sec-butanol 54.39
    n-hexane 6.91
    ethylene glycol 4.91
    NMP 173.06
    cyclohexane 25.04
    DMSO 49.75
    n-butyl acetate 134.41
    n-octanol 31.01
    chloroform 469.15
    n-propyl acetate 82.68
    acetic acid 43.39
    dichloromethane 309.6
    cyclohexanone 253.76
    propylene glycol 12.17
    isopropyl acetate 147.32
    DMAc 193.69
    2-ethoxyethanol 71.51
    isopentanol 100.66
    n-heptane 7.47
    ethyl formate 53.58
    1,2-dichloroethane 173.8
    n-hexanol 93.33
    2-methoxyethanol 121.07
    isobutyl acetate 79.9
    tetrachloromethane 63.1
    n-pentyl acetate 97.8
    transcutol 460.15
    n-heptanol 50.48
    ethylbenzene 121.14
    MIBK 136.47
    2-propoxyethanol 193.16
    tert-butanol 86.83
    MTBE 103.7
    2-butoxyethanol 114.36
    propionic acid 43.96
    o-xylene 173.03
    formic acid 11.76
    diethyl ether 141.67
    m-xylene 279.82
    p-xylene 130.31
    chlorobenzene 242.63
    dimethyl carbonate 73.39
    n-octane 2.61
    formamide 24.49
    cyclopentanone 260.01
    2-pentanone 157.41
    anisole 199.46
    cyclopentyl methyl ether 238.88
    gamma-butyrolactone 217.32
    1-methoxy-2-propanol 153.56
    pyridine 372.79
    3-pentanone 123.88
    furfural 209.04
    n-dodecane 1.8
    diethylene glycol 80.36
    diisopropyl ether 57.85
    tert-amyl alcohol 55.19
    acetylacetone 175.69
    n-hexadecane 2.28
    acetophenone 156.08
    methyl propionate 123.94
    isopentyl acetate 150.8
    trichloroethylene 395.77
    n-nonanol 33.99
    cyclohexanol 103.63
    benzyl alcohol 119.54
    2-ethylhexanol 57.61
    isooctanol 47.17
    dipropyl ether 87.68
    1,2-dichlorobenzene 203.5
    ethyl lactate 44.38
    propylene carbonate 131.63
    n-methylformamide 62.22
    2-pentanol 68.46
    n-pentane 12.15
    1-propoxy-2-propanol 156.13
    1-methoxy-2-propyl acetate 207.72
    2-(2-methoxypropoxy) propanol 113.39
    mesitylene 133.94
    ε-caprolactone 207.19
    p-cymene 65.52
    epichlorohydrin 293.43
    1,1,1-trichloroethane 187.61
    2-aminoethanol 22.08
    morpholine-4-carbaldehyde 269.19
    sulfolane 155.04
    2,2,4-trimethylpentane 6.81
    2-methyltetrahydrofuran 229.83
    n-hexyl acetate 107.48
    isooctane 8.39
    2-(2-butoxyethoxy)ethanol 156.5
    sec-butyl acetate 86.23
    tert-butyl acetate 158.61
    decalin 14.26
    glycerin 21.5
    diglyme 287.94
    acrylic acid 37.68
    isopropyl myristate 47.08
    n-butyric acid 104.04
    acetyl acetate 105.9
    di(2-ethylhexyl) phthalate 58.07
    ethyl propionate 92.22
    nitromethane 78.03
    1,2-diethoxyethane 161.67
    benzonitrile 167.76
    trioctyl phosphate 35.06
    1-bromopropane 124.83
    gamma-valerolactone 357.76
    n-decanol 23.56
    triethyl phosphate 56.96
    4-methyl-2-pentanol 62.02
    propionitrile 101.05
    vinylene carbonate 137.07
    1,1,2-trichlorotrifluoroethane 137.43
    DMS 114.89
    cumene 74.13
    2-octanol 28.85
    2-hexanone 83.11
    octyl acetate 52.78
    limonene 67.46
    1,2-dimethoxyethane 170.93
    ethyl orthosilicate 59.24
    tributyl phosphate 40.64
    diacetone alcohol 133.31
    N,N-dimethylaniline 130.87
    acrylonitrile 106.31
    aniline 246.35
    1,3-propanediol 54.3
    bromobenzene 269.94
    dibromomethane 201.62
    1,1,2,2-tetrachloroethane 300.62
    2-methyl-cyclohexyl acetate 99.97
    tetrabutyl urea 53.06
    diisobutyl methanol 46.06
    2-phenylethanol 154.31
    styrene 144.18
    dioctyl adipate 70.39
    dimethyl sulfate 82.26
    ethyl butyrate 101.06
    methyl lactate 56.05
    butyl lactate 80.67
    diethyl carbonate 68.35
    propanediol butyl ether 82.03
    triethyl orthoformate 88.47
    p-tert-butyltoluene 67.46
    methyl 4-tert-butylbenzoate 139.48
    morpholine 354.51
    tert-butylamine 65.19
    n-dodecanol 16.37
    dimethoxymethane 234.46
    ethylene carbonate 116.54
    cyrene 106.35
    2-ethoxyethyl acetate 163.91
    2-ethylhexyl acetate 118.98
    1,2,4-trichlorobenzene 223.51
    4-methylpyridine 402.56
    dibutyl ether 46.52
    2,6-dimethyl-4-heptanol 46.06
    DEF 146.73
    dimethyl isosorbide 225.92
    tetrachloroethylene 180.49
    eugenol 127.61
    triacetin 123.0
    span 80 92.82
    1,4-butanediol 15.09
    1,1-dichloroethane 184.31
    2-methyl-1-pentanol 52.58
    methyl formate 42.11
    2-methyl-1-butanol 77.08
    n-decane 4.04
    butyronitrile 116.89
    3,7-dimethyl-1-octanol 44.67
    1-chlorooctane 25.57
    1-chlorotetradecane 8.36
    n-nonane 3.32
    undecane 2.58
    tert-butylcyclohexane 12.36
    cyclooctane 10.07
    cyclopentanol 78.85
    tetrahydropyran 317.9
    tert-amyl methyl ether 74.09
    2,5,8-trioxanonane 177.58
    1-hexene 32.84
    2-isopropoxyethanol 64.72
    2,2,2-trifluoroethanol 21.69
    methyl butyrate 101.04

    Scent© AI

1 of 4
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
Name CAS Botanical Proportion
Guarea macrophylla ssp. tuberculata leaf Guarea macrophylla Vahl. ssp. tuberculata Vellozo, fam. Meliaceae 2.2%