(6R)-4,4a-dimethyl-6-propan-2-yl-5,6-dihydronaphthalen-2-one

Overview IFRA Botanical Request a quote

  • Identifiers

    Molecular formula
    C15H20O

    SMILES
    CC1=CC(=O)C=C2C1(C[C@@H](C=C2)C(C)C)C

  • Odor profile

    Fruity 72.34%
    Woody 51.11%
    Spicy 47.7%
    Mint 36.3%
    Herbal 32.88%
    Fresh 27.83%
    Berry 27.35%
    Dry 26.96%
    Tobacco 25.63%
    Citrus 22.29%

    Scent© AI

  • Properties

    XLogP3-AA
    3.4

    pKa est.
    8.13 (weak base)

    Molecular weight
    216.32 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    313°C

    Flash point est.
    126.02 ˚C

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 124.0
    methanol 78.98
    isopropanol 144.89
    water 0.12
    ethyl acetate 263.75
    n-propanol 162.22
    acetone 250.66
    n-butanol 140.57
    acetonitrile 168.92
    DMF 490.71
    toluene 467.33
    isobutanol 130.97
    1,4-dioxane 570.37
    methyl acetate 305.44
    THF 746.58
    2-butanone 402.2
    n-pentanol 82.56
    sec-butanol 127.1
    n-hexane 16.78
    ethylene glycol 15.05
    NMP 250.95
    cyclohexane 55.11
    DMSO 139.79
    n-butyl acetate 244.26
    n-octanol 75.38
    chloroform 741.65
    n-propyl acetate 150.22
    acetic acid 48.34
    dichloromethane 557.31
    cyclohexanone 464.29
    propylene glycol 33.58
    isopropyl acetate 169.41
    DMAc 356.02
    2-ethoxyethanol 101.8
    isopentanol 130.1
    n-heptane 18.53
    ethyl formate 117.83
    1,2-dichloroethane 361.07
    n-hexanol 181.57
    2-methoxyethanol 184.99
    isobutyl acetate 126.16
    tetrachloromethane 91.37
    n-pentyl acetate 149.34
    transcutol 409.7
    n-heptanol 90.03
    ethylbenzene 173.22
    MIBK 166.38
    2-propoxyethanol 249.12
    tert-butanol 174.35
    MTBE 216.13
    2-butoxyethanol 135.93
    propionic acid 83.34
    o-xylene 215.87
    formic acid 12.96
    diethyl ether 219.15
    m-xylene 261.57
    p-xylene 217.0
    chlorobenzene 303.38
    dimethyl carbonate 101.57
    n-octane 11.39
    formamide 35.76
    cyclopentanone 507.65
    2-pentanone 261.97
    anisole 258.22
    cyclopentyl methyl ether 270.88
    gamma-butyrolactone 371.69
    1-methoxy-2-propanol 190.53
    pyridine 521.31
    3-pentanone 236.56
    furfural 288.48
    n-dodecane 9.69
    diethylene glycol 123.13
    diisopropyl ether 73.52
    tert-amyl alcohol 128.31
    acetylacetone 226.76
    n-hexadecane 11.74
    acetophenone 205.84
    methyl propionate 231.82
    isopentyl acetate 245.67
    trichloroethylene 674.92
    n-nonanol 73.43
    cyclohexanol 163.71
    benzyl alcohol 164.1
    2-ethylhexanol 118.25
    isooctanol 75.98
    dipropyl ether 116.7
    1,2-dichlorobenzene 238.37
    ethyl lactate 72.34
    propylene carbonate 189.63
    n-methylformamide 139.11
    2-pentanol 104.24
    n-pentane 21.04
    1-propoxy-2-propanol 213.38
    1-methoxy-2-propyl acetate 250.23
    2-(2-methoxypropoxy) propanol 146.29
    mesitylene 143.98
    ε-caprolactone 320.2
    p-cymene 97.74
    epichlorohydrin 479.52
    1,1,1-trichloroethane 369.73
    2-aminoethanol 47.41
    morpholine-4-carbaldehyde 335.43
    sulfolane 255.01
    2,2,4-trimethylpentane 13.45
    2-methyltetrahydrofuran 451.56
    n-hexyl acetate 193.09
    isooctane 13.9
    2-(2-butoxyethoxy)ethanol 175.95
    sec-butyl acetate 133.3
    tert-butyl acetate 186.27
    decalin 29.57
    glycerin 38.22
    diglyme 301.99
    acrylic acid 63.01
    isopropyl myristate 84.86
    n-butyric acid 134.15
    acetyl acetate 128.62
    di(2-ethylhexyl) phthalate 82.14
    ethyl propionate 149.03
    nitromethane 147.45
    1,2-diethoxyethane 220.76
    benzonitrile 237.94
    trioctyl phosphate 58.41
    1-bromopropane 262.06
    gamma-valerolactone 502.37
    n-decanol 57.18
    triethyl phosphate 79.02
    4-methyl-2-pentanol 79.06
    propionitrile 234.12
    vinylene carbonate 191.27
    1,1,2-trichlorotrifluoroethane 174.44
    DMS 193.38
    cumene 105.19
    2-octanol 68.27
    2-hexanone 177.11
    octyl acetate 104.18
    limonene 117.85
    1,2-dimethoxyethane 245.96
    ethyl orthosilicate 78.87
    tributyl phosphate 68.28
    diacetone alcohol 176.96
    N,N-dimethylaniline 163.39
    acrylonitrile 238.84
    aniline 280.52
    1,3-propanediol 80.86
    bromobenzene 347.02
    dibromomethane 390.56
    1,1,2,2-tetrachloroethane 505.12
    2-methyl-cyclohexyl acetate 142.35
    tetrabutyl urea 89.93
    diisobutyl methanol 71.37
    2-phenylethanol 217.38
    styrene 194.94
    dioctyl adipate 104.05
    dimethyl sulfate 118.48
    ethyl butyrate 151.13
    methyl lactate 83.16
    butyl lactate 107.73
    diethyl carbonate 105.89
    propanediol butyl ether 119.16
    triethyl orthoformate 108.66
    p-tert-butyltoluene 100.05
    methyl 4-tert-butylbenzoate 168.5
    morpholine 591.25
    tert-butylamine 120.97
    n-dodecanol 44.9
    dimethoxymethane 277.79
    ethylene carbonate 162.31
    cyrene 133.3
    2-ethoxyethyl acetate 211.44
    2-ethylhexyl acetate 196.89
    1,2,4-trichlorobenzene 275.6
    4-methylpyridine 530.28
    dibutyl ether 97.61
    2,6-dimethyl-4-heptanol 71.37
    DEF 236.77
    dimethyl isosorbide 262.49
    tetrachloroethylene 263.73
    eugenol 158.29
    triacetin 168.94
    span 80 124.21
    1,4-butanediol 29.34
    1,1-dichloroethane 416.25
    2-methyl-1-pentanol 96.22
    methyl formate 102.45
    2-methyl-1-butanol 118.58
    n-decane 16.14
    butyronitrile 204.38
    3,7-dimethyl-1-octanol 87.25
    1-chlorooctane 66.69
    1-chlorotetradecane 31.16
    n-nonane 14.34
    undecane 12.26
    tert-butylcyclohexane 27.72
    cyclooctane 19.88
    cyclopentanol 152.32
    tetrahydropyran 585.11
    tert-amyl methyl ether 140.54
    2,5,8-trioxanonane 207.31
    1-hexene 77.97
    2-isopropoxyethanol 100.21
    2,2,2-trifluoroethanol 25.56
    methyl butyrate 178.09

    Scent© AI

1 3

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
Spikenard 2 8022-22-8 Nardostachys jatamansi (Roxb.) DC., fam. Valerianaceae 0.01%