1,11-Dodecadiene

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    5876-87-9

    Molecular formula
    C12H22

    SMILES
    C=CCCCCCCCCC=C

  • Odor profile

    Citrus 57.19%
    Gassy 42.06%
    Waxy 41.87%
    Herbal 38.97%
    Sweet 36.18%
    Green 34.22%
    Fatty 33.53%
    Fresh 33.35%
    Oily 26.35%
    Fishy 24.35%

    Scent© AI

  • Properties

    XLogP3-AA
    6.3

    Molecular weight
    166.3 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderate

    Boiling point est.
    210°C

    Flash point est.
    78.11 ˚C

  • Synonyms

    • 1,11-DODECADIENE
    • 5876-87-9
    • dodeca-1,11-diene
    • Dodecadiene, 1,11-
    • MFCD00048156
    • DTXSID60207492
    • DTXCID60129983
    • AKOS006229978
    • BS-22654
    • SY055028
    • DB-053262
    • D0283
    • D89622

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 323.33
    methanol 151.26
    isopropanol 432.88
    water 0.0
    ethyl acetate 1354.09
    n-propanol 422.27
    acetone 931.65
    n-butanol 667.64
    acetonitrile 276.18
    DMF 454.28
    toluene 1135.36
    isobutanol 415.8
    1,4-dioxane 1795.84
    methyl acetate 613.87
    THF 4363.48
    2-butanone 1116.68
    n-pentanol 496.47
    sec-butanol 637.46
    n-hexane 2535.22
    ethylene glycol 14.81
    NMP 646.83
    cyclohexane 3823.83
    DMSO 827.13
    n-butyl acetate 2985.48
    n-octanol 397.9
    chloroform 2177.88
    n-propyl acetate 1115.4
    acetic acid 159.7
    dichloromethane 2129.23
    cyclohexanone 2009.5
    propylene glycol 52.94
    isopropyl acetate 1099.53
    DMAc 469.29
    2-ethoxyethanol 367.5
    isopentanol 762.5
    n-heptane 3506.73
    ethyl formate 306.2
    1,2-dichloroethane 1895.11
    n-hexanol 1243.31
    2-methoxyethanol 422.45
    isobutyl acetate 827.01
    tetrachloromethane 665.58
    n-pentyl acetate 936.48
    transcutol 2104.42
    n-heptanol 414.25
    ethylbenzene 645.66
    MIBK 1047.54
    2-propoxyethanol 980.27
    tert-butanol 974.82
    MTBE 2246.07
    2-butoxyethanol 479.59
    propionic acid 212.89
    o-xylene 622.25
    formic acid 10.41
    diethyl ether 2972.14
    m-xylene 706.58
    p-xylene 729.91
    chlorobenzene 836.54
    dimethyl carbonate 143.45
    n-octane 628.17
    formamide 20.87
    cyclopentanone 1760.31
    2-pentanone 1475.2
    anisole 689.35
    cyclopentyl methyl ether 2744.25
    gamma-butyrolactone 1156.17
    1-methoxy-2-propanol 530.32
    pyridine 1380.84
    3-pentanone 1062.29
    furfural 678.92
    n-dodecane 205.9
    diethylene glycol 234.56
    diisopropyl ether 1350.96
    tert-amyl alcohol 950.28
    acetylacetone 983.87
    n-hexadecane 254.62
    acetophenone 505.88
    methyl propionate 638.51
    isopentyl acetate 2146.07
    trichloroethylene 2109.13
    n-nonanol 400.71
    cyclohexanol 1063.39
    benzyl alcohol 289.88
    2-ethylhexanol 1489.16
    isooctanol 449.55
    dipropyl ether 5295.74
    1,2-dichlorobenzene 749.96
    ethyl lactate 216.03
    propylene carbonate 742.13
    n-methylformamide 112.0
    2-pentanol 788.11
    n-pentane 1555.61
    1-propoxy-2-propanol 1428.36
    1-methoxy-2-propyl acetate 1286.39
    2-(2-methoxypropoxy) propanol 477.37
    mesitylene 569.21
    ε-caprolactone 1378.3
    p-cymene 723.19
    epichlorohydrin 1698.4
    1,1,1-trichloroethane 2043.2
    2-aminoethanol 55.63
    morpholine-4-carbaldehyde 638.99
    sulfolane 1384.95
    2,2,4-trimethylpentane 461.25
    2-methyltetrahydrofuran 3644.56
    n-hexyl acetate 1047.75
    isooctane 438.43
    2-(2-butoxyethoxy)ethanol 660.05
    sec-butyl acetate 927.89
    tert-butyl acetate 1385.75
    decalin 877.16
    glycerin 62.01
    diglyme 1448.98
    acrylic acid 107.69
    isopropyl myristate 533.11
    n-butyric acid 673.24
    acetyl acetate 570.15
    di(2-ethylhexyl) phthalate 248.53
    ethyl propionate 935.06
    nitromethane 272.07
    1,2-diethoxyethane 2650.31
    benzonitrile 462.05
    trioctyl phosphate 230.56
    1-bromopropane 2851.69
    gamma-valerolactone 1265.0
    n-decanol 303.76
    triethyl phosphate 559.8
    4-methyl-2-pentanol 543.55
    propionitrile 507.16
    vinylene carbonate 409.3
    1,1,2-trichlorotrifluoroethane 613.77
    DMS 393.43
    cumene 433.49
    2-octanol 354.12
    2-hexanone 1316.34
    octyl acetate 511.47
    limonene 1731.59
    1,2-dimethoxyethane 1495.15
    ethyl orthosilicate 667.8
    tributyl phosphate 333.22
    diacetone alcohol 798.46
    N,N-dimethylaniline 483.74
    acrylonitrile 322.58
    aniline 529.27
    1,3-propanediol 145.26
    bromobenzene 1175.25
    dibromomethane 2076.21
    1,1,2,2-tetrachloroethane 2137.06
    2-methyl-cyclohexyl acetate 1082.17
    tetrabutyl urea 427.79
    diisobutyl methanol 1072.8
    2-phenylethanol 521.31
    styrene 755.07
    dioctyl adipate 567.52
    dimethyl sulfate 220.63
    ethyl butyrate 2277.83
    methyl lactate 139.68
    butyl lactate 403.45
    diethyl carbonate 925.31
    propanediol butyl ether 250.7
    triethyl orthoformate 1481.65
    p-tert-butyltoluene 738.33
    methyl 4-tert-butylbenzoate 441.93
    morpholine 1962.45
    tert-butylamine 1090.85
    n-dodecanol 259.08
    dimethoxymethane 678.82
    ethylene carbonate 464.9
    cyrene 306.46
    2-ethoxyethyl acetate 810.98
    2-ethylhexyl acetate 1997.39
    1,2,4-trichlorobenzene 779.28
    4-methylpyridine 1234.97
    dibutyl ether 2543.54
    2,6-dimethyl-4-heptanol 1072.8
    DEF 1100.23
    dimethyl isosorbide 988.99
    tetrachloroethylene 1275.66
    eugenol 309.81
    triacetin 544.63
    span 80 489.77
    1,4-butanediol 54.25
    1,1-dichloroethane 1789.76
    2-methyl-1-pentanol 584.33
    methyl formate 94.71
    2-methyl-1-butanol 644.02
    n-decane 465.57
    butyronitrile 876.65
    3,7-dimethyl-1-octanol 664.76
    1-chlorooctane 903.47
    1-chlorotetradecane 327.05
    n-nonane 583.24
    undecane 290.99
    tert-butylcyclohexane 678.17
    cyclooctane 1375.74
    cyclopentanol 770.03
    tetrahydropyran 4317.51
    tert-amyl methyl ether 1729.39
    2,5,8-trioxanonane 844.84
    1-hexene 3080.29
    2-isopropoxyethanol 427.98
    2,2,2-trifluoroethanol 32.5
    methyl butyrate 1147.71

    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

Botanical

Name CAS Botanical Proportion
Dendranthema vestitum flower absolute (China) Dendranthema vestitum (Hemsl.) Ling ex Shih, fam. Asteraceae (Compositae) 6.8%