Cyclotridecanone

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  • Identifiers

    CAS number
    832-10-0

    Molecular formula
    C13H24O

    SMILES
    C1CCCCCCC(=O)CCCCC1

  • Odor profile

    Fragrance
    Musk 89.6%
    Animal 69.83%
    Powdery 58.71%
    Amber 50.11%
    Dry 42.45%
    Woody 39.81%
    Natural 39.74%
    Clean 37.44%
    Floral 34.22%
    Sweet 33.9%

     

    Flavor
    Fruity 37.93%
    Animal 32.19%
    Minty 30.43%
    Camphor 23.81%
    Musk 22.83%
    Shrimp 21.71%
    Natural 21.05%
    Beet 20.24%
    Alkaline 19.99%
    Soil 19.95%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    4.7

    pKa est.
    9.87 (weak base)

    Molecular weight
    196.33 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    291°C

    Flash point

    • 131.84 ˚C est.

  • Synonyms

    • Cyclotridecanone
    • 832-10-0
    • cyclotridecan-1-one
    • EINECS 212-615-3
    • DTXSID90232212
    • cyclotridecanon
    • M9P6DXT6YX
    • SCHEMBL6067572
    • DTXCID90154703
    • AKOS015915686
    • DB-243371
    • NS00038242
    • 212-615-3

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 693.37
    methanol 496.38
    isopropanol 856.94
    water 0.07
    ethyl acetate 1320.02
    n-propanol 910.72
    acetone 1409.27
    n-butanol 783.04
    acetonitrile 1021.15
    DMF 1582.94
    toluene 1451.46
    isobutanol 701.26
    1,4-dioxane 1753.99
    methyl acetate 1029.41
    THF 3164.24
    2-butanone 1354.02
    n-pentanol 495.97
    sec-butanol 803.37
    n-hexane 509.86
    ethylene glycol 77.87
    NMP 1886.55
    cyclohexane 1087.21
    DMSO 1626.38
    n-butyl acetate 1447.19
    n-octanol 458.29
    chloroform 5568.56
    n-propyl acetate 1129.51
    acetic acid 705.29
    dichloromethane 4573.32
    cyclohexanone 2959.02
    propylene glycol 206.74
    isopropyl acetate 943.62
    DMAc 950.59
    2-ethoxyethanol 504.61
    isopentanol 683.89
    n-heptane 491.63
    ethyl formate 934.88
    1,2-dichloroethane 2441.82
    n-hexanol 655.62
    2-methoxyethanol 909.58
    isobutyl acetate 698.6
    tetrachloromethane 1058.77
    n-pentyl acetate 1130.17
    transcutol 2083.57
    n-heptanol 419.57
    ethylbenzene 704.43
    MIBK 751.33
    2-propoxyethanol 786.6
    tert-butanol 890.88
    MTBE 799.52
    2-butoxyethanol 674.45
    propionic acid 949.4
    o-xylene 709.57
    formic acid 114.26
    diethyl ether 1169.12
    m-xylene 739.9
    p-xylene 859.74
    chlorobenzene 1985.8
    dimethyl carbonate 355.86
    n-octane 163.17
    formamide 251.47
    cyclopentanone 3250.68
    2-pentanone 1284.66
    anisole 953.06
    cyclopentyl methyl ether 1697.57
    gamma-butyrolactone 3294.0
    1-methoxy-2-propanol 851.97
    pyridine 2885.3
    3-pentanone 1007.6
    furfural 2569.75
    n-dodecane 85.47
    diethylene glycol 366.45
    diisopropyl ether 441.56
    tert-amyl alcohol 705.07
    acetylacetone 1271.58
    n-hexadecane 103.2
    acetophenone 983.52
    methyl propionate 972.33
    isopentyl acetate 1117.99
    trichloroethylene 4862.71
    n-nonanol 408.22
    cyclohexanol 1335.89
    benzyl alcohol 697.94
    2-ethylhexanol 566.73
    isooctanol 377.25
    dipropyl ether 1226.28
    1,2-dichlorobenzene 1730.08
    ethyl lactate 400.42
    propylene carbonate 2007.85
    n-methylformamide 779.17
    2-pentanol 665.36
    n-pentane 368.87
    1-propoxy-2-propanol 883.7
    1-methoxy-2-propyl acetate 912.92
    2-(2-methoxypropoxy) propanol 517.47
    mesitylene 460.68
    ε-caprolactone 2214.35
    p-cymene 469.73
    epichlorohydrin 2708.14
    1,1,1-trichloroethane 2703.09
    2-aminoethanol 273.84
    morpholine-4-carbaldehyde 1499.54
    sulfolane 3378.18
    2,2,4-trimethylpentane 114.91
    2-methyltetrahydrofuran 2285.56
    n-hexyl acetate 1268.94
    isooctane 103.11
    2-(2-butoxyethoxy)ethanol 780.29
    sec-butyl acetate 747.89
    tert-butyl acetate 864.73
    decalin 335.15
    glycerin 255.55
    diglyme 1553.99
    acrylic acid 740.76
    isopropyl myristate 481.16
    n-butyric acid 1531.91
    acetyl acetate 825.21
    di(2-ethylhexyl) phthalate 359.07
    ethyl propionate 958.65
    nitromethane 1229.57
    1,2-diethoxyethane 1133.71
    benzonitrile 1474.93
    trioctyl phosphate 287.18
    1-bromopropane 1749.6
    gamma-valerolactone 2853.89
    n-decanol 283.96
    triethyl phosphate 448.49
    4-methyl-2-pentanol 356.56
    propionitrile 1170.17
    vinylene carbonate 1653.56
    1,1,2-trichlorotrifluoroethane 1733.24
    DMS 716.18
    cumene 411.03
    2-octanol 375.27
    2-hexanone 986.75
    octyl acetate 555.64
    limonene 740.11
    1,2-dimethoxyethane 1262.41
    ethyl orthosilicate 441.69
    tributyl phosphate 382.98
    diacetone alcohol 758.66
    N,N-dimethylaniline 603.77
    acrylonitrile 1349.04
    aniline 1271.27
    1,3-propanediol 477.06
    bromobenzene 2436.37
    dibromomethane 3350.35
    1,1,2,2-tetrachloroethane 3952.83
    2-methyl-cyclohexyl acetate 761.88
    tetrabutyl urea 489.41
    diisobutyl methanol 430.9
    2-phenylethanol 620.91
    styrene 1019.84
    dioctyl adipate 674.26
    dimethyl sulfate 566.5
    ethyl butyrate 1140.27
    methyl lactate 413.03
    butyl lactate 726.53
    diethyl carbonate 678.42
    propanediol butyl ether 584.86
    triethyl orthoformate 788.97
    p-tert-butyltoluene 423.42
    methyl 4-tert-butylbenzoate 738.81
    morpholine 2055.93
    tert-butylamine 709.29
    n-dodecanol 212.92
    dimethoxymethane 821.45
    ethylene carbonate 1551.86
    cyrene 519.64
    2-ethoxyethyl acetate 931.43
    2-ethylhexyl acetate 935.29
    1,2,4-trichlorobenzene 1834.66
    4-methylpyridine 2393.06
    dibutyl ether 1105.96
    2,6-dimethyl-4-heptanol 430.9
    DEF 1278.92
    dimethyl isosorbide 1057.21
    tetrachloroethylene 2664.26
    eugenol 579.49
    triacetin 944.3
    span 80 655.04
    1,4-butanediol 168.49
    1,1-dichloroethane 2632.98
    2-methyl-1-pentanol 431.99
    methyl formate 600.81
    2-methyl-1-butanol 625.68
    n-decane 175.94
    butyronitrile 1304.61
    3,7-dimethyl-1-octanol 495.2
    1-chlorooctane 612.68
    1-chlorotetradecane 209.32
    n-nonane 204.69
    undecane 115.21
    tert-butylcyclohexane 233.62
    cyclooctane 362.95
    cyclopentanol 1434.48
    tetrahydropyran 2542.42
    tert-amyl methyl ether 642.89
    2,5,8-trioxanonane 914.52
    1-hexene 980.83
    2-isopropoxyethanol 428.78
    2,2,2-trifluoroethanol 265.22
    methyl butyrate 1428.8

    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