Cyclododeca(c)furan, tetradecahydro-

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  • Identifiers

    CAS number
    42824-62-4

    Molecular formula
    C14H26O

    SMILES
    C1CCCCCC2COCC2CCCC1

  • Odor profile

    Fragrance
    Woody 70.82%
    Musk 67.12%
    Amber 62.97%
    Dry 56.84%
    Animal 53.48%
    Cedar 41.59%
    Earthy 33.96%
    Natural 31.1%
    Camphoreous 30.39%
    Clean 29.31%

     

    Flavor
    Animal 39.32%
    Ammoniacal 24.94%
    Alkaline 23.89%
    Shrimp 23.2%
    Beet 21.22%
    Soil 21.04%
    Cereal 19.66%
    Cauliflower 19.36%
    Terpenic 19.22%
    Plant 19.02%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    5.2

    pKa est.
    8.9 (weak base)

    Molecular weight
    210.36 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very slow

    Boiling point est.
    295°C

    Flash point

    • 125.81 ˚C est.

  • Synonyms

    • tetradecahydrocyclododeca[c]furan
    • 42824-62-4
    • Cyclododeca[c]furan, tetradecahydro-
    • EINECS 255-957-9
    • 14-Oxabicyclo(10.3.0)pentadecane
    • Cyclododeca(c)furan, tetradecahydro-
    • Tetradecahydrocyclododeca(c)furan
    • DTXSID20885876
    • TETRADECAHYDRO-CYCLODODECA[C]FURAN
    • SCHEMBL3506522
    • Cyclododecacfuran, tetradecahydro-
    • ZOMKNVYKXOZLFE-UHFFFAOYSA-N
    • DTXCID001025235
    • STL560926
    • AKOS030489451
    • DB-246383
    • NS00060683
    • 255-957-9

  • Applications

    Chemical name: Cyclododeca(c)furan, tetradecahydro-; CAS number: 42824-62-4 is a saturated alicyclic furan derivative that is primarily used as a chemical building block and intermediate in the synthesis of specialty polymers and resins; it may also function as a solvent or processing aid in coatings, inks, and adhesives, and as a plasticizer or additive to tune flexibility and processing characteristics of polymer formulations. Additionally, it may be employed as a building block in fragrance or cosmetic ingredient synthesis, and as a co-solvent or cleaning formulation component in industrial cleaners.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 881.96
    methanol 511.12
    isopropanol 890.61
    water 0.26
    ethyl acetate 2051.87
    n-propanol 1149.91
    acetone 1708.77
    n-butanol 1068.8
    acetonitrile 1257.23
    DMF 1475.73
    toluene 2023.14
    isobutanol 949.41
    1,4-dioxane 2937.36
    methyl acetate 1482.17
    THF 4674.11
    2-butanone 1680.14
    n-pentanol 634.78
    sec-butanol 936.21
    n-hexane 553.37
    ethylene glycol 164.56
    NMP 1832.57
    cyclohexane 1590.85
    DMSO 1526.77
    n-butyl acetate 1902.52
    n-octanol 519.01
    chloroform 7275.38
    n-propyl acetate 1495.41
    acetic acid 1098.28
    dichloromethane 6127.72
    cyclohexanone 3501.8
    propylene glycol 313.31
    isopropyl acetate 1574.54
    DMAc 1060.97
    2-ethoxyethanol 826.52
    isopentanol 1018.62
    n-heptane 640.33
    ethyl formate 1340.76
    1,2-dichloroethane 3452.78
    n-hexanol 858.19
    2-methoxyethanol 1208.55
    isobutyl acetate 1114.69
    tetrachloromethane 1832.16
    n-pentyl acetate 1442.44
    transcutol 2668.56
    n-heptanol 577.21
    ethylbenzene 921.97
    MIBK 1158.72
    2-propoxyethanol 1093.53
    tert-butanol 1021.02
    MTBE 1318.91
    2-butoxyethanol 947.95
    propionic acid 1261.38
    o-xylene 1050.11
    formic acid 210.56
    diethyl ether 1762.84
    m-xylene 1156.35
    p-xylene 1079.89
    chlorobenzene 2540.35
    dimethyl carbonate 669.93
    n-octane 237.83
    formamide 367.08
    cyclopentanone 3848.49
    2-pentanone 1629.57
    anisole 1231.92
    cyclopentyl methyl ether 2483.63
    gamma-butyrolactone 3989.17
    1-methoxy-2-propanol 1067.44
    pyridine 3299.04
    3-pentanone 1437.57
    furfural 3039.44
    n-dodecane 134.14
    diethylene glycol 592.04
    diisopropyl ether 797.98
    tert-amyl alcohol 893.34
    acetylacetone 1702.05
    n-hexadecane 162.21
    acetophenone 1143.69
    methyl propionate 1429.12
    isopentyl acetate 1620.53
    trichloroethylene 5754.2
    n-nonanol 480.33
    cyclohexanol 1738.6
    benzyl alcohol 906.45
    2-ethylhexanol 767.18
    isooctanol 551.45
    dipropyl ether 1536.56
    1,2-dichlorobenzene 2261.51
    ethyl lactate 581.73
    propylene carbonate 2540.38
    n-methylformamide 951.72
    2-pentanol 868.27
    n-pentane 578.36
    1-propoxy-2-propanol 1100.13
    1-methoxy-2-propyl acetate 1367.46
    2-(2-methoxypropoxy) propanol 671.65
    mesitylene 801.89
    ε-caprolactone 2894.5
    p-cymene 698.95
    epichlorohydrin 3564.94
    1,1,1-trichloroethane 3777.81
    2-aminoethanol 399.74
    morpholine-4-carbaldehyde 1823.46
    sulfolane 3668.85
    2,2,4-trimethylpentane 248.39
    2-methyltetrahydrofuran 3231.09
    n-hexyl acetate 1384.52
    isooctane 238.47
    2-(2-butoxyethoxy)ethanol 932.55
    sec-butyl acetate 1105.25
    tert-butyl acetate 1475.57
    decalin 496.46
    glycerin 410.77
    diglyme 2074.85
    acrylic acid 1043.76
    isopropyl myristate 616.67
    n-butyric acid 2020.12
    acetyl acetate 1506.48
    di(2-ethylhexyl) phthalate 441.7
    ethyl propionate 1283.14
    nitromethane 1686.46
    1,2-diethoxyethane 1636.48
    benzonitrile 1732.02
    trioctyl phosphate 374.17
    1-bromopropane 2358.68
    gamma-valerolactone 3528.4
    n-decanol 351.76
    triethyl phosphate 645.47
    4-methyl-2-pentanol 575.56
    propionitrile 1582.76
    vinylene carbonate 2162.83
    1,1,2-trichlorotrifluoroethane 2220.35
    DMS 912.7
    cumene 603.22
    2-octanol 456.9
    2-hexanone 1153.01
    octyl acetate 678.8
    limonene 1043.6
    1,2-dimethoxyethane 1703.31
    ethyl orthosilicate 650.76
    tributyl phosphate 495.55
    diacetone alcohol 1005.72
    N,N-dimethylaniline 741.16
    acrylonitrile 1667.75
    aniline 1675.93
    1,3-propanediol 692.83
    bromobenzene 3155.29
    dibromomethane 4317.47
    1,1,2,2-tetrachloroethane 4772.51
    2-methyl-cyclohexyl acetate 1001.82
    tetrabutyl urea 526.11
    diisobutyl methanol 612.82
    2-phenylethanol 845.05
    styrene 1207.49
    dioctyl adipate 778.27
    dimethyl sulfate 930.11
    ethyl butyrate 1521.86
    methyl lactate 648.58
    butyl lactate 823.84
    diethyl carbonate 1013.95
    propanediol butyl ether 624.87
    triethyl orthoformate 1148.88
    p-tert-butyltoluene 641.9
    methyl 4-tert-butylbenzoate 952.06
    morpholine 2734.92
    tert-butylamine 894.94
    n-dodecanol 282.41
    dimethoxymethane 1305.54
    ethylene carbonate 2131.88
    cyrene 655.5
    2-ethoxyethyl acetate 1376.81
    2-ethylhexyl acetate 1396.14
    1,2,4-trichlorobenzene 2358.78
    4-methylpyridine 2720.94
    dibutyl ether 1171.49
    2,6-dimethyl-4-heptanol 612.82
    DEF 1526.57
    dimethyl isosorbide 1279.16
    tetrachloroethylene 3479.93
    eugenol 699.29
    triacetin 1202.24
    span 80 741.69
    1,4-butanediol 299.5
    1,1-dichloroethane 3346.3
    2-methyl-1-pentanol 620.31
    methyl formate 844.74
    2-methyl-1-butanol 937.05
    n-decane 249.48
    butyronitrile 1625.98
    3,7-dimethyl-1-octanol 613.95
    1-chlorooctane 731.65
    1-chlorotetradecane 292.75
    n-nonane 273.2
    undecane 173.33
    tert-butylcyclohexane 361.77
    cyclooctane 635.93
    cyclopentanol 1804.62
    tetrahydropyran 3844.91
    tert-amyl methyl ether 1036.2
    2,5,8-trioxanonane 1142.61
    1-hexene 1033.83
    2-isopropoxyethanol 690.77
    2,2,2-trifluoroethanol 532.87
    methyl butyrate 1665.11

    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