1,5-Cyclododecadiene, 9-methoxy-1,6,10-trimethyl-

  • Identifiers

    CAS number
    900779-74-0

    Molecular formula
    C16H28O

    SMILES
    CC1CC/C(=C/CC/C=C(/CCC1OC)\C)/C

  • Odor profile

    Fragrance
    Woody 66.48%
    Herbal 57.47%
    Citrus 56.35%
    Spicy 49.19%
    Lemon 39.9%
    Fresh 36.55%
    Earthy 35.98%
    Dry 35.41%
    Amber 34.68%
    Terpenic 32.62%

     

    Flavor
    Woody 35.99%
    Herbal 34.59%
    Fruity 33.64%
    Spicy 31.04%
    Herb 29.43%
    Earthy 27.94%
    Wood 26.57%
    Spice 26.02%
    Mint 23.72%
    Musty 23.19%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    4.0

    pKa est.
    9.71 (weak base)

    Molecular weight
    236.39 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    298°C

    Flash point

    • 100.29 ˚C est.

  • Synonyms

    • 1,5-CYCLODODECADIENE, 9-METHOXY-1,6,10-TRIMETHYL-
    • 900779-74-0
    • DTXSID60889237
    • KVUDYRZHDCHPGF-FNCQTZNRSA-N
    • DTXCID101028501
  • Applications

    1,5-Cyclododecadiene, 9-methoxy-1,6,10-trimethyl- (CAS 900779-74-0) finds applications as a building block in fragrance chemistry and as an aroma intermediate in cosmetics; it may serve as an odorant or a fixative in perfumery to influence scent volatility and longevity. It is also considered a specialty monomer or intermediate for the synthesis of fragrance-related compounds and for certain polymer/resin formulations in plastics and coatings. In coatings and inks, it can function as a reactive monomer or modifier to tailor film properties and scent characteristics. It may also be used in household product formulations as a fragrance component, subject to regulatory constraints. Overall, the material is typically employed as an intermediate/building block rather than a bulk ingredient.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 681.88
    methanol 301.87
    isopropanol 667.56
    water 0.17
    ethyl acetate 1627.49
    n-propanol 718.41
    acetone 678.36
    n-butanol 956.28
    acetonitrile 524.74
    DMF 329.85
    toluene 1683.85
    isobutanol 627.33
    1,4-dioxane 2321.58
    methyl acetate 840.88
    THF 2241.64
    2-butanone 929.3
    n-pentanol 640.13
    sec-butanol 810.46
    n-hexane 688.2
    ethylene glycol 35.94
    NMP 490.7
    cyclohexane 1470.29
    DMSO 390.15
    n-butyl acetate 1626.18
    n-octanol 420.26
    chloroform 3704.36
    n-propyl acetate 940.48
    acetic acid 495.0
    dichloromethane 2730.05
    cyclohexanone 1417.5
    propylene glycol 99.71
    isopropyl acetate 1247.47
    DMAc 534.1
    2-ethoxyethanol 586.11
    isopentanol 1015.14
    n-heptane 627.44
    ethyl formate 495.06
    1,2-dichloroethane 1588.97
    n-hexanol 1121.71
    2-methoxyethanol 593.78
    isobutyl acetate 714.46
    tetrachloromethane 911.98
    n-pentyl acetate 903.11
    transcutol 2965.19
    n-heptanol 511.68
    ethylbenzene 783.1
    MIBK 790.86
    2-propoxyethanol 975.57
    tert-butanol 1047.99
    MTBE 1893.57
    2-butoxyethanol 697.6
    propionic acid 415.01
    o-xylene 879.08
    formic acid 60.04
    diethyl ether 2361.07
    m-xylene 1028.95
    p-xylene 882.81
    chlorobenzene 1256.28
    dimethyl carbonate 222.43
    n-octane 170.96
    formamide 87.93
    cyclopentanone 996.46
    2-pentanone 1025.22
    anisole 909.44
    cyclopentyl methyl ether 1511.41
    gamma-butyrolactone 896.0
    1-methoxy-2-propanol 590.44
    pyridine 1733.99
    3-pentanone 863.44
    furfural 882.96
    n-dodecane 92.54
    diethylene glycol 346.0
    diisopropyl ether 884.48
    tert-amyl alcohol 1021.09
    acetylacetone 875.05
    n-hexadecane 108.16
    acetophenone 697.3
    methyl propionate 693.15
    isopentyl acetate 1489.07
    trichloroethylene 2691.2
    n-nonanol 407.67
    cyclohexanol 1119.28
    benzyl alcohol 551.46
    2-ethylhexanol 894.35
    isooctanol 482.5
    dipropyl ether 1570.06
    1,2-dichlorobenzene 1049.05
    ethyl lactate 265.6
    propylene carbonate 714.67
    n-methylformamide 159.66
    2-pentanol 865.73
    n-pentane 718.95
    1-propoxy-2-propanol 949.88
    1-methoxy-2-propyl acetate 1130.43
    2-(2-methoxypropoxy) propanol 625.33
    mesitylene 700.42
    ε-caprolactone 1283.99
    p-cymene 577.02
    epichlorohydrin 1457.18
    1,1,1-trichloroethane 2072.82
    2-aminoethanol 132.2
    morpholine-4-carbaldehyde 768.24
    sulfolane 748.03
    2,2,4-trimethylpentane 275.73
    2-methyltetrahydrofuran 2237.36
    n-hexyl acetate 1030.59
    isooctane 231.05
    2-(2-butoxyethoxy)ethanol 904.08
    sec-butyl acetate 842.31
    tert-butyl acetate 1168.94
    decalin 424.03
    glycerin 122.57
    diglyme 1725.0
    acrylic acid 270.43
    isopropyl myristate 437.87
    n-butyric acid 1033.25
    acetyl acetate 947.13
    di(2-ethylhexyl) phthalate 334.0
    ethyl propionate 780.51
    nitromethane 475.83
    1,2-diethoxyethane 1834.22
    benzonitrile 834.6
    trioctyl phosphate 245.04
    1-bromopropane 1658.4
    gamma-valerolactone 1230.56
    n-decanol 295.4
    triethyl phosphate 398.87
    4-methyl-2-pentanol 566.84
    propionitrile 690.65
    vinylene carbonate 646.27
    1,1,2-trichlorotrifluoroethane 770.38
    DMS 560.49
    cumene 526.71
    2-octanol 357.89
    2-hexanone 771.84
    octyl acetate 503.46
    limonene 874.19
    1,2-dimethoxyethane 1294.12
    ethyl orthosilicate 469.06
    tributyl phosphate 318.59
    diacetone alcohol 710.67
    N,N-dimethylaniline 616.31
    acrylonitrile 501.24
    aniline 981.19
    1,3-propanediol 311.15
    bromobenzene 1568.19
    dibromomethane 2251.11
    1,1,2,2-tetrachloroethane 2285.03
    2-methyl-cyclohexyl acetate 765.41
    tetrabutyl urea 350.25
    diisobutyl methanol 570.35
    2-phenylethanol 707.31
    styrene 881.21
    dioctyl adipate 523.84
    dimethyl sulfate 242.6
    ethyl butyrate 1158.21
    methyl lactate 215.98
    butyl lactate 461.41
    diethyl carbonate 679.18
    propanediol butyl ether 405.92
    triethyl orthoformate 859.81
    p-tert-butyltoluene 560.29
    methyl 4-tert-butylbenzoate 629.15
    morpholine 2123.65
    tert-butylamine 983.36
    n-dodecanol 240.8
    dimethoxymethane 538.2
    ethylene carbonate 654.29
    cyrene 400.09
    2-ethoxyethyl acetate 1029.34
    2-ethylhexyl acetate 1274.36
    1,2,4-trichlorobenzene 1155.88
    4-methylpyridine 1702.74
    dibutyl ether 1004.03
    2,6-dimethyl-4-heptanol 570.35
    DEF 887.06
    dimethyl isosorbide 980.25
    tetrachloroethylene 1670.72
    eugenol 503.2
    triacetin 786.69
    span 80 606.96
    1,4-butanediol 131.64
    1,1-dichloroethane 1808.46
    2-methyl-1-pentanol 710.19
    methyl formate 135.05
    2-methyl-1-butanol 927.29
    n-decane 176.47
    butyronitrile 974.19
    3,7-dimethyl-1-octanol 539.81
    1-chlorooctane 502.83
    1-chlorotetradecane 200.21
    n-nonane 187.57
    undecane 119.18
    tert-butylcyclohexane 345.75
    cyclooctane 550.33
    cyclopentanol 644.88
    tetrahydropyran 3110.98
    tert-amyl methyl ether 1259.61
    2,5,8-trioxanonane 969.47
    1-hexene 1218.34
    2-isopropoxyethanol 558.78
    2,2,2-trifluoroethanol 141.55
    methyl butyrate 888.19

    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