1,2,3,4,4a,5,6,7,8,8a-Decahydronaphthalene-2-carboxylate

  • Identifiers

    Molecular formula
    C11H17O2-

    SMILES
    C1CCC2CC(CCC2C1)C(=O)[O-]

  • Odor profile

    Fragrance
    Green 42.51%
    Balsamic 40.11%
    Fruity 38.86%
    Floral 37.05%
    Animal 31.12%
    Woody 31.11%
    Fresh 28.61%
    Herbal 25.92%
    Mint 24.66%
    Amber 24.39%

     

    Flavor
    Fruity 28.08%
    Animal 23.38%
    Odorless 21.68%
    Alkaline 20.9%
    Shrimp 20.66%
    Fruit 20.1%
    Soil 20.01%
    Plant 20.01%
    Beet 19.99%
    Urine 19.85%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    3.9

    pKa est.
    6.09 (neutral)

    Molecular weight
    181.25 g/mol

    Flash point

    • 106.9 ˚C est.

  • Applications

    1,2,3,4,4a,5,6,7,8,8a-Decahydronaphthalene-2-carboxylate is used as an organic synthesis intermediate, providing a rigid bicyclic decalin scaffold for related derivatives and material substrates. In industry, it is commonly evaluated as a building block for hard-ring compounds and their derivatives, and as an intermediate for the production of polymers and synthetic rubbers. Other potential applications include use as a fragrance-related intermediate in perfumery, and as a nonpolar component or processing aid in coatings and inks. Additionally, it may serve as a starting material for synthesizing other bicyclic derivatives in industrial manufacturing, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 270.46
    methanol 380.4
    isopropanol 168.47
    water 1.02
    ethyl acetate 764.12
    n-propanol 221.04
    acetone 1094.32
    n-butanol 178.64
    acetonitrile 385.12
    DMF 1125.03
    toluene 319.44
    isobutanol 142.46
    1,4-dioxane 896.76
    methyl acetate 590.4
    THF 1952.21
    2-butanone 730.85
    n-pentanol 115.44
    sec-butanol 132.95
    n-hexane 14.99
    ethylene glycol 119.55
    NMP 1746.85
    cyclohexane 34.08
    DMSO 2296.16
    n-butyl acetate 485.72
    n-octanol 65.31
    chloroform 1220.52
    n-propyl acetate 385.48
    acetic acid 470.51
    dichloromethane 1504.15
    cyclohexanone 1080.64
    propylene glycol 122.22
    isopropyl acetate 465.11
    DMAc 732.96
    2-ethoxyethanol 378.61
    isopentanol 182.66
    n-heptane 9.5
    ethyl formate 454.7
    1,2-dichloroethane 1448.27
    n-hexanol 156.41
    2-methoxyethanol 785.03
    isobutyl acetate 192.99
    tetrachloromethane 195.06
    n-pentyl acetate 271.45
    transcutol 3364.95
    n-heptanol 71.77
    ethylbenzene 149.34
    MIBK 361.16
    2-propoxyethanol 486.95
    tert-butanol 236.5
    MTBE 275.4
    2-butoxyethanol 263.14
    propionic acid 394.41
    o-xylene 211.04
    formic acid 311.72
    diethyl ether 340.76
    m-xylene 223.77
    p-xylene 156.55
    chlorobenzene 660.41
    dimethyl carbonate 397.28
    n-octane 3.71
    formamide 759.03
    cyclopentanone 2140.72
    2-pentanone 623.28
    anisole 453.36
    cyclopentyl methyl ether 703.31
    gamma-butyrolactone 2462.25
    1-methoxy-2-propanol 583.89
    pyridine 921.98
    3-pentanone 466.88
    furfural 1904.55
    n-dodecane 2.6
    diethylene glycol 451.95
    diisopropyl ether 127.0
    tert-amyl alcohol 187.33
    acetylacetone 1199.95
    n-hexadecane 3.27
    acetophenone 480.15
    methyl propionate 665.05
    isopentyl acetate 407.76
    trichloroethylene 2893.75
    n-nonanol 59.72
    cyclohexanol 213.69
    benzyl alcohol 306.41
    2-ethylhexanol 96.82
    isooctanol 61.67
    dipropyl ether 148.19
    1,2-dichlorobenzene 685.51
    ethyl lactate 186.2
    propylene carbonate 1051.06
    n-methylformamide 888.28
    2-pentanol 123.97
    n-pentane 13.68
    1-propoxy-2-propanol 342.55
    1-methoxy-2-propyl acetate 662.07
    2-(2-methoxypropoxy) propanol 370.38
    mesitylene 136.8
    ε-caprolactone 1034.05
    p-cymene 85.52
    epichlorohydrin 2605.69
    1,1,1-trichloroethane 882.47
    2-aminoethanol 200.83
    morpholine-4-carbaldehyde 1393.75
    sulfolane 3241.4
    2,2,4-trimethylpentane 11.62
    2-methyltetrahydrofuran 1096.03
    n-hexyl acetate 367.56
    isooctane 10.79
    2-(2-butoxyethoxy)ethanol 579.86
    sec-butyl acetate 262.99
    tert-butyl acetate 545.41
    decalin 22.85
    glycerin 240.36
    diglyme 1163.0
    acrylic acid 439.28
    isopropyl myristate 98.7
    n-butyric acid 480.84
    acetyl acetate 589.63
    di(2-ethylhexyl) phthalate 130.39
    ethyl propionate 376.8
    nitromethane 1606.86
    1,2-diethoxyethane 577.91
    benzonitrile 465.31
    trioctyl phosphate 81.99
    1-bromopropane 333.17
    gamma-valerolactone 2227.65
    n-decanol 42.23
    triethyl phosphate 156.53
    4-methyl-2-pentanol 92.37
    propionitrile 282.41
    vinylene carbonate 856.95
    1,1,2-trichlorotrifluoroethane 1168.14
    DMS 528.49
    cumene 90.65
    2-octanol 46.14
    2-hexanone 344.23
    octyl acetate 137.99
    limonene 109.41
    1,2-dimethoxyethane 665.61
    ethyl orthosilicate 136.36
    tributyl phosphate 136.77
    diacetone alcohol 580.13
    N,N-dimethylaniline 231.49
    acrylonitrile 498.17
    aniline 470.31
    1,3-propanediol 317.35
    bromobenzene 644.8
    dibromomethane 743.3
    1,1,2,2-tetrachloroethane 1844.66
    2-methyl-cyclohexyl acetate 225.89
    tetrabutyl urea 149.94
    diisobutyl methanol 68.85
    2-phenylethanol 301.84
    styrene 205.55
    dioctyl adipate 194.43
    dimethyl sulfate 846.59
    ethyl butyrate 304.26
    methyl lactate 343.69
    butyl lactate 251.13
    diethyl carbonate 214.6
    propanediol butyl ether 304.16
    triethyl orthoformate 198.53
    p-tert-butyltoluene 81.82
    methyl 4-tert-butylbenzoate 337.41
    morpholine 960.71
    tert-butylamine 120.7
    n-dodecanol 29.75
    dimethoxymethane 854.57
    ethylene carbonate 691.78
    cyrene 380.8
    2-ethoxyethyl acetate 631.03
    2-ethylhexyl acetate 303.41
    1,2,4-trichlorobenzene 859.9
    4-methylpyridine 858.83
    dibutyl ether 113.78
    2,6-dimethyl-4-heptanol 68.85
    DEF 664.85
    dimethyl isosorbide 805.15
    tetrachloroethylene 1199.82
    eugenol 312.45
    triacetin 468.38
    span 80 261.78
    1,4-butanediol 98.52
    1,1-dichloroethane 827.73
    2-methyl-1-pentanol 124.96
    methyl formate 724.78
    2-methyl-1-butanol 149.9
    n-decane 4.9
    butyronitrile 240.7
    3,7-dimethyl-1-octanol 91.16
    1-chlorooctane 52.63
    1-chlorotetradecane 15.37
    n-nonane 4.66
    undecane 3.42
    tert-butylcyclohexane 18.35
    cyclooctane 14.63
    cyclopentanol 350.43
    tetrahydropyran 682.36
    tert-amyl methyl ether 207.09
    2,5,8-trioxanonane 685.36
    1-hexene 64.25
    2-isopropoxyethanol 252.72
    2,2,2-trifluoroethanol 289.63
    methyl butyrate 457.15

    Scent© AI

1 of 3
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