2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;(4R,6R)-1,6-dimethyl-4-propan-2-ylcyclohexene;(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane

  • Identifiers

    Molecular formula
    C32H56

    SMILES
    C[C@@H]1C[C@@H](CCC1=C)C(C)C.C[C@@H]1C[C@@H](CC=C1C)C(C)C.CC1(C2CCC(C2)C1=C)C

  • Odor profile

    Fragrance
    Herbal 80.06%
    Woody 71.5%
    Spicy 66.58%
    Citrus 63.08%
    Fresh 62.27%
    Terpenic 61.19%
    Pine 53.71%
    Mint 53.25%
    Green 51.97%
    Camphoreous 50.6%

     

    Flavor
    Woody 64.11%
    Wood 46.91%
    Spice 46.44%
    Herbal 45.14%
    Herb 39.72%
    Terpene 35.47%
    Citrus 33.0%
    Turpentine 30.23%
    Pine 29.1%
    Camphor 25.33%

     

    Odor impact est.
    Medium

  • Properties

    pKa est.
    10.25 (weak base)

    Molecular weight
    440.8 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Fast

    Boiling point est.
    191°C

    Flash point

    • 56.92 ˚C est.

  • Synonyms

    • 2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;(4R,6R)-1,6-dimethyl-4-propan-2-ylcyclohexene;(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane
  • Applications

    2,2-dimethyl-3-methylidenebicyclo[2.2.1]heptane;(4R,6R)-1,6-dimethyl-4-propan-2-ylcyclohexene;(2R,4R)-2-methyl-1-methylidene-4-propan-2-ylcyclohexane is a specialty hydrocarbon considered for fragrance and cosmetic applications as an odorant and potential fixative; it may also be evaluated as a flavor/fragrance ingredient for foods. In industrial manufacturing, it serves as a chemical intermediate and building block for organic syntheses. The norbornene-type core suggests potential use as a monomer or reactive intermediate in ROMP-based polymers and advanced coatings. It may also function as an intermediate in the synthesis of specialty resins for coatings or adhesives. Use is subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 926.82
    methanol 264.81
    isopropanol 1204.81
    water 0.06
    ethyl acetate 1711.95
    n-propanol 1034.0
    acetone 1122.89
    n-butanol 1261.19
    acetonitrile 984.8
    DMF 507.66
    toluene 1388.22
    isobutanol 872.08
    1,4-dioxane 2566.54
    methyl acetate 1083.94
    THF 4260.9
    2-butanone 1488.57
    n-pentanol 685.92
    sec-butanol 1125.63
    n-hexane 729.26
    ethylene glycol 30.19
    NMP 441.0
    cyclohexane 1153.55
    DMSO 490.66
    n-butyl acetate 3591.34
    n-octanol 700.87
    chloroform 2619.25
    n-propyl acetate 928.65
    acetic acid 288.26
    dichloromethane 2318.3
    cyclohexanone 1799.83
    propylene glycol 111.05
    isopropyl acetate 1177.8
    DMAc 472.08
    2-ethoxyethanol 487.55
    isopentanol 1129.8
    n-heptane 1507.53
    ethyl formate 728.4
    1,2-dichloroethane 1431.17
    n-hexanol 2387.78
    2-methoxyethanol 698.23
    isobutyl acetate 649.39
    tetrachloromethane 725.83
    n-pentyl acetate 1008.63
    transcutol 2336.59
    n-heptanol 736.86
    ethylbenzene 574.27
    MIBK 979.57
    2-propoxyethanol 1588.96
    tert-butanol 1683.66
    MTBE 2448.2
    2-butoxyethanol 735.41
    propionic acid 398.68
    o-xylene 627.36
    formic acid 24.31
    diethyl ether 2493.72
    m-xylene 861.03
    p-xylene 640.98
    chlorobenzene 1018.78
    dimethyl carbonate 187.25
    n-octane 340.89
    formamide 55.56
    cyclopentanone 1685.56
    2-pentanone 1426.98
    anisole 770.45
    cyclopentyl methyl ether 1821.55
    gamma-butyrolactone 1301.08
    1-methoxy-2-propanol 824.33
    pyridine 1866.56
    3-pentanone 955.18
    furfural 770.26
    n-dodecane 173.67
    diethylene glycol 387.66
    diisopropyl ether 1003.32
    tert-amyl alcohol 1198.63
    acetylacetone 998.23
    n-hexadecane 202.08
    acetophenone 478.56
    methyl propionate 787.38
    isopentyl acetate 2573.46
    trichloroethylene 1922.37
    n-nonanol 606.5
    cyclohexanol 1119.51
    benzyl alcohol 373.7
    2-ethylhexanol 1731.93
    isooctanol 594.22
    dipropyl ether 3391.42
    1,2-dichlorobenzene 709.61
    ethyl lactate 190.77
    propylene carbonate 784.81
    n-methylformamide 229.78
    2-pentanol 1043.89
    n-pentane 719.51
    1-propoxy-2-propanol 1844.12
    1-methoxy-2-propyl acetate 1479.65
    2-(2-methoxypropoxy) propanol 608.53
    mesitylene 545.53
    ε-caprolactone 1379.1
    p-cymene 767.29
    epichlorohydrin 1734.63
    1,1,1-trichloroethane 1812.83
    2-aminoethanol 139.81
    morpholine-4-carbaldehyde 714.17
    sulfolane 771.05
    2,2,4-trimethylpentane 252.07
    2-methyltetrahydrofuran 3320.29
    n-hexyl acetate 1292.86
    isooctane 294.58
    2-(2-butoxyethoxy)ethanol 924.67
    sec-butyl acetate 682.65
    tert-butyl acetate 1238.26
    decalin 332.07
    glycerin 98.35
    diglyme 1624.3
    acrylic acid 185.55
    isopropyl myristate 546.89
    n-butyric acid 1117.16
    acetyl acetate 698.37
    di(2-ethylhexyl) phthalate 313.3
    ethyl propionate 742.99
    nitromethane 472.16
    1,2-diethoxyethane 2360.92
    benzonitrile 768.27
    trioctyl phosphate 272.75
    1-bromopropane 2047.63
    gamma-valerolactone 1478.43
    n-decanol 472.7
    triethyl phosphate 387.81
    4-methyl-2-pentanol 663.98
    propionitrile 1250.83
    vinylene carbonate 604.96
    1,1,2-trichlorotrifluoroethane 468.23
    DMS 459.83
    cumene 372.73
    2-octanol 531.35
    2-hexanone 1063.56
    octyl acetate 619.92
    limonene 1275.3
    1,2-dimethoxyethane 1436.75
    ethyl orthosilicate 452.93
    tributyl phosphate 344.22
    diacetone alcohol 763.37
    N,N-dimethylaniline 445.78
    acrylonitrile 787.49
    aniline 899.85
    1,3-propanediol 362.56
    bromobenzene 1257.78
    dibromomethane 1982.59
    1,1,2,2-tetrachloroethane 1443.85
    2-methyl-cyclohexyl acetate 846.49
    tetrabutyl urea 405.24
    diisobutyl methanol 968.43
    2-phenylethanol 791.98
    styrene 670.36
    dioctyl adipate 515.74
    dimethyl sulfate 168.11
    ethyl butyrate 1799.01
    methyl lactate 179.5
    butyl lactate 454.01
    diethyl carbonate 793.74
    propanediol butyl ether 438.53
    triethyl orthoformate 1021.22
    p-tert-butyltoluene 757.08
    methyl 4-tert-butylbenzoate 531.03
    morpholine 2593.09
    tert-butylamine 1490.64
    n-dodecanol 380.86
    dimethoxymethane 761.25
    ethylene carbonate 655.18
    cyrene 285.58
    2-ethoxyethyl acetate 926.58
    2-ethylhexyl acetate 2132.07
    1,2,4-trichlorobenzene 710.63
    4-methylpyridine 1843.6
    dibutyl ether 1791.7
    2,6-dimethyl-4-heptanol 968.43
    DEF 930.99
    dimethyl isosorbide 1020.58
    tetrachloroethylene 889.19
    eugenol 377.16
    triacetin 578.77
    span 80 597.27
    1,4-butanediol 102.21
    1,1-dichloroethane 1950.35
    2-methyl-1-pentanol 673.36
    methyl formate 176.17
    2-methyl-1-butanol 935.54
    n-decane 336.05
    butyronitrile 1783.35
    3,7-dimethyl-1-octanol 823.23
    1-chlorooctane 782.99
    1-chlorotetradecane 284.16
    n-nonane 378.93
    undecane 227.51
    tert-butylcyclohexane 326.92
    cyclooctane 466.01
    cyclopentanol 949.66
    tetrahydropyran 4006.06
    tert-amyl methyl ether 1344.59
    2,5,8-trioxanonane 953.8
    1-hexene 1476.84
    2-isopropoxyethanol 459.69
    2,2,2-trifluoroethanol 64.25
    methyl butyrate 930.3

    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