(1S,7S)-3,3,7-trimethyl-8-methylidenetricyclo[5.4.0.02,9]undecane

  • Identifiers

    Molecular formula
    C15H24

    SMILES
    C[C@]12CCCC(C3[C@@H]1CCC3C2=C)(C)C

  • Odor profile

    Fragrance
    Woody 88.79%
    Sweet 53.49%
    Dry 47.77%
    Amber 44.78%
    Cedar 44.5%
    Spicy 39.42%
    Camphoreous 37.77%
    Sandalwood 35.66%
    Balsamic 35.43%
    Fresh 34.21%

     

    Flavor
    Woody 70.54%
    Sweet 61.0%
    Wood 42.96%
    Dry 41.97%
    Camphor 37.88%
    Pine 35.45%
    Balsam 34.54%
    Fir needle 34.34%
    Balsamic 32.02%
    Medical 30.24%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    5.1

    pKa est.
    10.0 (weak base)

    Molecular weight
    204.35 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    269°C

    Flash point

    • 80.7 ˚C est.

  • Synonyms

    • PDSNLYSELAIEBU-PQNSMMMDSA-N
  • Applications

    Chemical name: (1S,7S)-3,3,7-trimethyl-8-methylidenetricyclo[5.4.0.02,9]undecane; CAS number: In practice, the compound is viewed as a potential fragrance ingredient and odorant with possible use in perfumery; in cosmetics and personal care as a fragrance component or fixative; in household products as a fragrance additive for cleaning formulations; in polymers and plastics as a building block or intermediate for polymer synthesis; and in coatings, inks, and adhesives as a specialty additive or intermediate.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 554.38
    methanol 543.41
    isopropanol 618.16
    water 2.11
    ethyl acetate 1120.9
    n-propanol 614.31
    acetone 1262.66
    n-butanol 631.05
    acetonitrile 942.92
    DMF 1333.27
    toluene 1435.68
    isobutanol 526.75
    1,4-dioxane 2237.42
    methyl acetate 900.0
    THF 4418.31
    2-butanone 994.56
    n-pentanol 290.8
    sec-butanol 414.88
    n-hexane 202.38
    ethylene glycol 94.76
    NMP 944.8
    cyclohexane 479.42
    DMSO 644.56
    n-butyl acetate 1124.71
    n-octanol 359.27
    chloroform 2275.2
    n-propyl acetate 546.29
    acetic acid 304.45
    dichloromethane 1908.11
    cyclohexanone 1738.26
    propylene glycol 124.85
    isopropyl acetate 1066.98
    DMAc 696.42
    2-ethoxyethanol 406.13
    isopentanol 614.29
    n-heptane 238.86
    ethyl formate 605.2
    1,2-dichloroethane 1365.73
    n-hexanol 745.11
    2-methoxyethanol 802.84
    isobutyl acetate 511.89
    tetrachloromethane 648.87
    n-pentyl acetate 638.69
    transcutol 1190.87
    n-heptanol 392.03
    ethylbenzene 483.98
    MIBK 902.66
    2-propoxyethanol 1101.03
    tert-butanol 713.75
    MTBE 1116.98
    2-butoxyethanol 596.33
    propionic acid 357.08
    o-xylene 634.27
    formic acid 92.96
    diethyl ether 1333.13
    m-xylene 953.27
    p-xylene 589.18
    chlorobenzene 1129.91
    dimethyl carbonate 559.64
    n-octane 106.04
    formamide 168.42
    cyclopentanone 2210.32
    2-pentanone 1083.6
    anisole 787.54
    cyclopentyl methyl ether 1831.9
    gamma-butyrolactone 1988.87
    1-methoxy-2-propanol 772.76
    pyridine 1521.84
    3-pentanone 814.56
    furfural 1212.16
    n-dodecane 66.51
    diethylene glycol 554.59
    diisopropyl ether 618.8
    tert-amyl alcohol 444.3
    acetylacetone 1297.78
    n-hexadecane 80.13
    acetophenone 544.81
    methyl propionate 835.34
    isopentyl acetate 1073.82
    trichloroethylene 1968.46
    n-nonanol 317.47
    cyclohexanol 673.74
    benzyl alcohol 412.33
    2-ethylhexanol 497.22
    isooctanol 340.79
    dipropyl ether 902.38
    1,2-dichlorobenzene 916.28
    ethyl lactate 248.83
    propylene carbonate 1035.7
    n-methylformamide 589.3
    2-pentanol 456.51
    n-pentane 269.93
    1-propoxy-2-propanol 817.0
    1-methoxy-2-propyl acetate 1117.96
    2-(2-methoxypropoxy) propanol 441.91
    mesitylene 677.55
    ε-caprolactone 1291.18
    p-cymene 402.65
    epichlorohydrin 2004.95
    1,1,1-trichloroethane 1489.36
    2-aminoethanol 193.48
    morpholine-4-carbaldehyde 1164.66
    sulfolane 1448.43
    2,2,4-trimethylpentane 121.33
    2-methyltetrahydrofuran 2097.87
    n-hexyl acetate 762.08
    isooctane 157.32
    2-(2-butoxyethoxy)ethanol 597.96
    sec-butyl acetate 459.74
    tert-butyl acetate 1078.67
    decalin 181.96
    glycerin 191.78
    diglyme 1275.41
    acrylic acid 284.19
    isopropyl myristate 344.42
    n-butyric acid 713.62
    acetyl acetate 799.4
    di(2-ethylhexyl) phthalate 259.06
    ethyl propionate 565.05
    nitromethane 749.89
    1,2-diethoxyethane 854.0
    benzonitrile 778.29
    trioctyl phosphate 226.02
    1-bromopropane 1006.14
    gamma-valerolactone 2075.83
    n-decanol 228.25
    triethyl phosphate 316.57
    4-methyl-2-pentanol 395.38
    propionitrile 1008.48
    vinylene carbonate 900.64
    1,1,2-trichlorotrifluoroethane 686.31
    DMS 663.65
    cumene 336.01
    2-octanol 283.92
    2-hexanone 541.88
    octyl acetate 372.52
    limonene 527.87
    1,2-dimethoxyethane 1099.52
    ethyl orthosilicate 330.77
    tributyl phosphate 266.89
    diacetone alcohol 709.41
    N,N-dimethylaniline 493.14
    acrylonitrile 986.39
    aniline 839.31
    1,3-propanediol 388.92
    bromobenzene 1329.42
    dibromomethane 1393.12
    1,1,2,2-tetrachloroethane 1433.92
    2-methyl-cyclohexyl acetate 508.12
    tetrabutyl urea 301.16
    diisobutyl methanol 367.46
    2-phenylethanol 678.75
    styrene 572.3
    dioctyl adipate 360.95
    dimethyl sulfate 600.88
    ethyl butyrate 683.0
    methyl lactate 350.68
    butyl lactate 364.54
    diethyl carbonate 440.22
    propanediol butyl ether 374.01
    triethyl orthoformate 522.82
    p-tert-butyltoluene 436.59
    methyl 4-tert-butylbenzoate 609.19
    morpholine 1885.19
    tert-butylamine 587.37
    n-dodecanol 176.04
    dimethoxymethane 1521.95
    ethylene carbonate 917.52
    cyrene 378.46
    2-ethoxyethyl acetate 763.98
    2-ethylhexyl acetate 819.0
    1,2,4-trichlorobenzene 909.32
    4-methylpyridine 1544.8
    dibutyl ether 583.79
    2,6-dimethyl-4-heptanol 367.46
    DEF 837.42
    dimethyl isosorbide 942.64
    tetrachloroethylene 1047.97
    eugenol 469.77
    triacetin 518.86
    span 80 389.46
    1,4-butanediol 126.23
    1,1-dichloroethane 1404.41
    2-methyl-1-pentanol 290.38
    methyl formate 590.12
    2-methyl-1-butanol 491.25
    n-decane 121.54
    butyronitrile 1053.65
    3,7-dimethyl-1-octanol 387.78
    1-chlorooctane 361.65
    1-chlorotetradecane 150.42
    n-nonane 125.54
    undecane 86.43
    tert-butylcyclohexane 169.13
    cyclooctane 230.23
    cyclopentanol 715.28
    tetrahydropyran 2297.79
    tert-amyl methyl ether 649.29
    2,5,8-trioxanonane 715.5
    1-hexene 418.42
    2-isopropoxyethanol 342.65
    2,2,2-trifluoroethanol 188.33
    methyl butyrate 621.66

    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