3-Allyldecahydro-1-naphthol

Overview IFRA Request a quote

  • Identifiers

    CAS number
    94277-28-8

    Molecular formula
    C13H22O

    SMILES
    C=CCC1CC2CCCCC2C(C1)O

  • Odor profile

    Fragrance
    Green 65.72%
    Floral 63.84%
    Fruity 60.01%
    Herbal 54.18%
    Fresh 38.11%
    Woody 33.71%
    Jasmin 32.23%
    Citrus 31.9%
    Aldehydic 29.43%
    Mint 29.29%

     

    Flavor
    Herbal 31.68%
    Spice 29.67%
    Woody 28.74%
    Herb 28.14%
    Minty 25.75%
    Sweet 25.27%
    Mint 24.79%
    Fruity 23.66%
    Spicy 23.48%
    Fresh 22.51%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    3.9

    pKa est.
    8.25 (weak base)

    Molecular weight
    194.31 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    285°C

    Flash point

    • 121.94 ˚C est.

  • Synonyms

    • 3-Allyldecahydro-1-naphthol
    • 94277-28-8
    • EINECS 304-611-6
    • DTXSID50915817
    • IGCAFXSCRZBGGT-UHFFFAOYSA-N
    • NS00065311
    • 3-(Prop-2-en-1-yl)decahydronaphthalen-1-ol

  • Applications

    3-Allyldecahydro-1-naphthol, CAS 94277-28-8, finds practical use primarily as a fragrance-related ingredient and odorant: in the fragrance industry and cosmetics as a scent component and may serve as a fragrance fixative in certain formulations; as a synthetic intermediate for the preparation of more complex fragrance molecules in industrial manufacturing; as a scent additive in household products such as cleaners and detergents, subject to formulation constraints; and in R&D settings as a precursor in the synthesis pathways for new aroma compounds.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3850.68
    methanol 2811.16
    isopropanol 5151.35
    water 0.27
    ethyl acetate 2440.02
    n-propanol 3680.49
    acetone 3955.63
    n-butanol 3415.73
    acetonitrile 2357.92
    DMF 1844.31
    toluene 1137.44
    isobutanol 2494.22
    1,4-dioxane 5719.73
    methyl acetate 1562.81
    THF 7687.04
    2-butanone 2177.02
    n-pentanol 1215.02
    sec-butanol 2094.97
    n-hexane 283.68
    ethylene glycol 145.11
    NMP 573.85
    cyclohexane 819.74
    DMSO 1912.76
    n-butyl acetate 1856.58
    n-octanol 435.05
    chloroform 3697.61
    n-propyl acetate 1057.85
    acetic acid 993.19
    dichloromethane 2970.25
    cyclohexanone 2525.06
    propylene glycol 297.06
    isopropyl acetate 1605.36
    DMAc 642.8
    2-ethoxyethanol 1106.14
    isopentanol 2356.68
    n-heptane 263.17
    ethyl formate 1195.05
    1,2-dichloroethane 2228.59
    n-hexanol 1890.63
    2-methoxyethanol 2574.69
    isobutyl acetate 652.32
    tetrachloromethane 579.45
    n-pentyl acetate 685.69
    transcutol 4108.58
    n-heptanol 542.96
    ethylbenzene 291.72
    MIBK 1300.39
    2-propoxyethanol 2176.95
    tert-butanol 3873.24
    MTBE 3363.39
    2-butoxyethanol 870.74
    propionic acid 931.03
    o-xylene 391.07
    formic acid 170.44
    diethyl ether 5137.92
    m-xylene 651.4
    p-xylene 327.64
    chlorobenzene 979.2
    dimethyl carbonate 369.29
    n-octane 79.46
    formamide 314.15
    cyclopentanone 2500.16
    2-pentanone 2499.67
    anisole 568.26
    cyclopentyl methyl ether 2384.2
    gamma-butyrolactone 2216.92
    1-methoxy-2-propanol 2204.64
    pyridine 2442.79
    3-pentanone 1088.01
    furfural 1227.09
    n-dodecane 43.51
    diethylene glycol 911.13
    diisopropyl ether 1129.9
    tert-amyl alcohol 1328.79
    acetylacetone 1472.71
    n-hexadecane 51.43
    acetophenone 364.2
    methyl propionate 1200.48
    isopentyl acetate 1421.71
    trichloroethylene 2659.21
    n-nonanol 350.7
    cyclohexanol 1807.92
    benzyl alcohol 405.65
    2-ethylhexanol 764.58
    isooctanol 410.38
    dipropyl ether 1700.28
    1,2-dichlorobenzene 575.39
    ethyl lactate 250.81
    propylene carbonate 1061.12
    n-methylformamide 1115.22
    2-pentanol 2095.97
    n-pentane 518.56
    1-propoxy-2-propanol 1636.05
    1-methoxy-2-propyl acetate 1181.73
    2-(2-methoxypropoxy) propanol 486.87
    mesitylene 395.77
    ε-caprolactone 1623.27
    p-cymene 224.56
    epichlorohydrin 2788.71
    1,1,1-trichloroethane 1750.57
    2-aminoethanol 493.24
    morpholine-4-carbaldehyde 1122.33
    sulfolane 1351.45
    2,2,4-trimethylpentane 109.56
    2-methyltetrahydrofuran 3805.12
    n-hexyl acetate 789.83
    isooctane 163.94
    2-(2-butoxyethoxy)ethanol 932.6
    sec-butyl acetate 606.77
    tert-butyl acetate 1308.61
    decalin 124.52
    glycerin 344.42
    diglyme 1867.78
    acrylic acid 469.37
    isopropyl myristate 266.94
    n-butyric acid 2301.31
    acetyl acetate 830.15
    di(2-ethylhexyl) phthalate 178.09
    ethyl propionate 675.08
    nitromethane 1594.4
    1,2-diethoxyethane 2283.15
    benzonitrile 801.19
    trioctyl phosphate 160.42
    1-bromopropane 2027.2
    gamma-valerolactone 2481.87
    n-decanol 243.84
    triethyl phosphate 225.59
    4-methyl-2-pentanol 961.4
    propionitrile 2290.75
    vinylene carbonate 863.86
    1,1,2-trichlorotrifluoroethane 911.12
    DMS 386.36
    cumene 174.85
    2-octanol 316.13
    2-hexanone 1042.14
    octyl acetate 297.7
    limonene 391.17
    1,2-dimethoxyethane 2457.7
    ethyl orthosilicate 260.12
    tributyl phosphate 211.8
    diacetone alcohol 993.92
    N,N-dimethylaniline 255.73
    acrylonitrile 1643.83
    aniline 1060.74
    1,3-propanediol 1468.51
    bromobenzene 1028.84
    dibromomethane 2268.55
    1,1,2,2-tetrachloroethane 1919.83
    2-methyl-cyclohexyl acetate 423.81
    tetrabutyl urea 227.93
    diisobutyl methanol 541.01
    2-phenylethanol 565.47
    styrene 401.24
    dioctyl adipate 283.23
    dimethyl sulfate 322.6
    ethyl butyrate 983.09
    methyl lactate 370.23
    butyl lactate 392.85
    diethyl carbonate 496.42
    propanediol butyl ether 553.44
    triethyl orthoformate 597.63
    p-tert-butyltoluene 235.87
    methyl 4-tert-butylbenzoate 356.75
    morpholine 5590.88
    tert-butylamine 2688.96
    n-dodecanol 183.73
    dimethoxymethane 2496.25
    ethylene carbonate 951.03
    cyrene 293.84
    2-ethoxyethyl acetate 800.8
    2-ethylhexyl acetate 926.82
    1,2,4-trichlorobenzene 591.41
    4-methylpyridine 2031.56
    dibutyl ether 1002.4
    2,6-dimethyl-4-heptanol 541.01
    DEF 1301.31
    dimethyl isosorbide 759.09
    tetrachloroethylene 1294.87
    eugenol 307.65
    triacetin 427.67
    span 80 432.89
    1,4-butanediol 275.7
    1,1-dichloroethane 2890.45
    2-methyl-1-pentanol 768.02
    methyl formate 756.02
    2-methyl-1-butanol 1559.98
    n-decane 90.65
    butyronitrile 3025.86
    3,7-dimethyl-1-octanol 458.03
    1-chlorooctane 316.28
    1-chlorotetradecane 103.3
    n-nonane 98.15
    undecane 59.55
    tert-butylcyclohexane 115.73
    cyclooctane 218.01
    cyclopentanol 1666.94
    tetrahydropyran 7123.45
    tert-amyl methyl ether 1156.19
    2,5,8-trioxanonane 895.15
    1-hexene 929.5
    2-isopropoxyethanol 771.9
    2,2,2-trifluoroethanol 213.06
    methyl butyrate 983.5

    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