1-(1,2,8,8-Tetramethyl-1,2,3,4,5,6,7,8-octahydronaphthalen-2-yl)ethan-1-one

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  • Identifiers

    Molecular formula
    C16H26O

    SMILES
    CC1C2=C(CCCC2(C)C)CCC1(C)C(=O)C

  • Odor profile

    Woody 88.56%
    Amber 58.88%
    Musk 50.87%
    Floral 50.3%
    Dry 49.79%
    Orris 49.57%
    Cedar 46.24%
    Powdery 44.85%
    Vetiver 43.8%
    Tobacco 38.6%

    Scent© AI

  • Properties

    XLogP3-AA
    3.5

    pKa est.
    9.0 (weak base)

    Molecular weight
    234.38 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    312°C

    Flash point est.
    120.47 ˚C

  • Synonyms

    • SCHEMBL180129
    • DTXSID70861468
    • 1-(1,2,8,8-Tetramethyl-1,2,3,4,5,6,7,8-octahydronaphthalen-2-yl)ethan-1-one

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 267.28
    methanol 314.09
    isopropanol 251.71
    water 0.74
    ethyl acetate 681.6
    n-propanol 325.51
    acetone 791.33
    n-butanol 264.84
    acetonitrile 908.39
    DMF 1249.26
    toluene 1421.29
    isobutanol 253.89
    1,4-dioxane 1669.67
    methyl acetate 707.35
    THF 2437.38
    2-butanone 794.18
    n-pentanol 136.55
    sec-butanol 202.92
    n-hexane 50.08
    ethylene glycol 34.66
    NMP 1212.5
    cyclohexane 217.12
    DMSO 400.34
    n-butyl acetate 586.41
    n-octanol 157.49
    chloroform 2554.72
    n-propyl acetate 370.84
    acetic acid 229.45
    dichloromethane 2322.18
    cyclohexanone 1711.12
    propylene glycol 55.4
    isopropyl acetate 488.84
    DMAc 731.9
    2-ethoxyethanol 194.19
    isopentanol 246.67
    n-heptane 55.5
    ethyl formate 449.6
    1,2-dichloroethane 1251.34
    n-hexanol 319.56
    2-methoxyethanol 392.8
    isobutyl acetate 291.78
    tetrachloromethane 439.46
    n-pentyl acetate 402.25
    transcutol 808.42
    n-heptanol 175.39
    ethylbenzene 432.14
    MIBK 395.69
    2-propoxyethanol 494.93
    tert-butanol 293.82
    MTBE 405.65
    2-butoxyethanol 287.76
    propionic acid 287.97
    o-xylene 637.16
    formic acid 68.5
    diethyl ether 534.13
    m-xylene 775.36
    p-xylene 574.77
    chlorobenzene 1281.89
    dimethyl carbonate 309.68
    n-octane 23.93
    formamide 159.27
    cyclopentanone 2011.37
    2-pentanone 580.89
    anisole 668.04
    cyclopentyl methyl ether 955.33
    gamma-butyrolactone 1921.16
    1-methoxy-2-propanol 359.73
    pyridine 1906.08
    3-pentanone 558.68
    furfural 1372.05
    n-dodecane 16.76
    diethylene glycol 246.04
    diisopropyl ether 188.53
    tert-amyl alcohol 215.4
    acetylacetone 724.31
    n-hexadecane 21.54
    acetophenone 593.14
    methyl propionate 586.42
    isopentyl acetate 549.11
    trichloroethylene 2537.0
    n-nonanol 143.12
    cyclohexanol 447.77
    benzyl alcohol 413.62
    2-ethylhexanol 214.17
    isooctanol 150.44
    dipropyl ether 303.28
    1,2-dichlorobenzene 993.21
    ethyl lactate 145.56
    propylene carbonate 861.61
    n-methylformamide 525.16
    2-pentanol 171.68
    n-pentane 61.03
    1-propoxy-2-propanol 362.88
    1-methoxy-2-propyl acetate 563.7
    2-(2-methoxypropoxy) propanol 261.95
    mesitylene 439.11
    ε-caprolactone 1205.97
    p-cymene 271.11
    epichlorohydrin 1801.82
    1,1,1-trichloroethane 1323.04
    2-aminoethanol 98.94
    morpholine-4-carbaldehyde 1264.31
    sulfolane 1276.99
    2,2,4-trimethylpentane 35.02
    2-methyltetrahydrofuran 1357.45
    n-hexyl acetate 535.75
    isooctane 31.57
    2-(2-butoxyethoxy)ethanol 330.53
    sec-butyl acetate 284.71
    tert-butyl acetate 505.64
    decalin 82.7
    glycerin 79.53
    diglyme 770.09
    acrylic acid 259.83
    isopropyl myristate 188.54
    n-butyric acid 408.93
    acetyl acetate 490.87
    di(2-ethylhexyl) phthalate 183.41
    ethyl propionate 360.71
    nitromethane 771.1
    1,2-diethoxyethane 428.35
    benzonitrile 965.92
    trioctyl phosphate 128.21
    1-bromopropane 703.05
    gamma-valerolactone 2019.05
    n-decanol 96.44
    triethyl phosphate 187.18
    4-methyl-2-pentanol 126.65
    propionitrile 800.04
    vinylene carbonate 961.92
    1,1,2-trichlorotrifluoroethane 646.91
    DMS 546.61
    cumene 267.02
    2-octanol 130.77
    2-hexanone 357.76
    octyl acetate 225.36
    limonene 326.59
    1,2-dimethoxyethane 560.58
    ethyl orthosilicate 176.82
    tributyl phosphate 153.97
    diacetone alcohol 363.83
    N,N-dimethylaniline 415.35
    acrylonitrile 962.71
    aniline 831.64
    1,3-propanediol 161.74
    bromobenzene 1501.42
    dibromomethane 1329.11
    1,1,2,2-tetrachloroethane 1574.65
    2-methyl-cyclohexyl acetate 344.01
    tetrabutyl urea 201.02
    diisobutyl methanol 137.59
    2-phenylethanol 523.79
    styrene 528.18
    dioctyl adipate 245.64
    dimethyl sulfate 417.63
    ethyl butyrate 391.07
    methyl lactate 189.31
    butyl lactate 261.02
    diethyl carbonate 275.08
    propanediol butyl ether 214.41
    triethyl orthoformate 270.48
    p-tert-butyltoluene 265.78
    methyl 4-tert-butylbenzoate 441.57
    morpholine 1483.95
    tert-butylamine 227.65
    n-dodecanol 70.16
    dimethoxymethane 791.31
    ethylene carbonate 777.9
    cyrene 309.18
    2-ethoxyethyl acetate 535.03
    2-ethylhexyl acetate 460.87
    1,2,4-trichlorobenzene 1086.49
    4-methylpyridine 1877.3
    dibutyl ether 235.97
    2,6-dimethyl-4-heptanol 137.59
    DEF 621.91
    dimethyl isosorbide 673.78
    tetrachloroethylene 1068.74
    eugenol 373.56
    triacetin 439.46
    span 80 248.83
    1,4-butanediol 54.63
    1,1-dichloroethane 1244.45
    2-methyl-1-pentanol 153.93
    methyl formate 481.94
    2-methyl-1-butanol 218.97
    n-decane 33.39
    butyronitrile 709.12
    3,7-dimethyl-1-octanol 169.1
    1-chlorooctane 168.55
    1-chlorotetradecane 57.76
    n-nonane 31.49
    undecane 22.81
    tert-butylcyclohexane 65.05
    cyclooctane 69.95
    cyclopentanol 471.58
    tetrahydropyran 1601.38
    tert-amyl methyl ether 277.88
    2,5,8-trioxanonane 442.85
    1-hexene 173.35
    2-isopropoxyethanol 164.94
    2,2,2-trifluoroethanol 131.73
    methyl butyrate 445.66

    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