Pentadeca-2,4,6-trienal

  • Identifiers

    Molecular formula
    C15H24O

    SMILES
    CCCCCCCCC=CC=CC=CC=O

  • Odor profile

    Fragrance
    Fatty 88.17%
    Oily 59.73%
    Citrus 50.16%
    Waxy 49.42%
    Fruity 37.93%
    Aldehydic 34.17%
    Fishy 33.9%
    Green 30.21%
    Orange 28.62%
    Sweet 27.82%

     

    Flavor
    Citrus 41.95%
    Fatty 40.23%
    Orange 30.93%
    Cucumber 29.72%
    Wax 29.36%
    Melon 29.27%
    Spicy 28.97%
    Sweet 26.84%
    Pumpkin 25.63%
    Oriental 23.77%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    5.5

    pKa est.
    7.52 (neutral)

    Molecular weight
    220.35 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    301°C

    Flash point

    • 154.7 ˚C est.

  • Applications

    Pentadeca-2,4,6-trienal is primarily considered as an odorant and fragrance intermediate in perfumery, and may be used as a fragrance component in cosmetics and personal care products as well as in household and cleaning formulations; it can function as an aroma chemical intermediate in the synthesis of other fragrance compounds for industrial manufacturing; at low concentrations it may be evaluated for use as an aroma ingredient in flavor formulations, subject to local regulations and formulation limits; its role as a reactive aldehyde also makes it a potential building block in specialty polymer or coating formulations where scent contribution is desired.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 906.81
    methanol 652.2
    isopropanol 841.36
    water 0.01
    ethyl acetate 1346.4
    n-propanol 813.34
    acetone 1587.73
    n-butanol 776.41
    acetonitrile 481.58
    DMF 769.16
    toluene 458.75
    isobutanol 560.04
    1,4-dioxane 1221.9
    methyl acetate 697.37
    THF 2598.48
    2-butanone 1387.4
    n-pentanol 588.15
    sec-butanol 697.47
    n-hexane 342.66
    ethylene glycol 35.41
    NMP 619.12
    cyclohexane 498.15
    DMSO 1641.47
    n-butyl acetate 1173.78
    n-octanol 173.21
    chloroform 1605.97
    n-propyl acetate 1026.73
    acetic acid 296.4
    dichloromethane 1998.82
    cyclohexanone 1626.11
    propylene glycol 112.27
    isopropyl acetate 863.4
    DMAc 652.03
    2-ethoxyethanol 644.66
    isopentanol 709.38
    n-heptane 186.38
    ethyl formate 364.34
    1,2-dichloroethane 1924.44
    n-hexanol 635.88
    2-methoxyethanol 852.32
    isobutyl acetate 585.76
    tetrachloromethane 302.27
    n-pentyl acetate 531.3
    transcutol 2766.69
    n-heptanol 204.79
    ethylbenzene 276.08
    MIBK 834.45
    2-propoxyethanol 827.57
    tert-butanol 951.83
    MTBE 1290.44
    2-butoxyethanol 410.93
    propionic acid 329.96
    o-xylene 249.78
    formic acid 38.84
    diethyl ether 1888.94
    m-xylene 300.86
    p-xylene 289.98
    chlorobenzene 508.44
    dimethyl carbonate 141.35
    n-octane 49.9
    formamide 87.11
    cyclopentanone 1477.83
    2-pentanone 1466.98
    anisole 461.97
    cyclopentyl methyl ether 1397.81
    gamma-butyrolactone 1083.91
    1-methoxy-2-propanol 873.09
    pyridine 1054.1
    3-pentanone 833.55
    furfural 691.42
    n-dodecane 24.28
    diethylene glycol 302.16
    diisopropyl ether 483.03
    tert-amyl alcohol 689.86
    acetylacetone 1006.86
    n-hexadecane 29.28
    acetophenone 432.97
    methyl propionate 746.22
    isopentyl acetate 954.16
    trichloroethylene 2182.42
    n-nonanol 167.66
    cyclohexanol 703.41
    benzyl alcohol 320.79
    2-ethylhexanol 468.92
    isooctanol 212.15
    dipropyl ether 1158.76
    1,2-dichlorobenzene 467.37
    ethyl lactate 229.86
    propylene carbonate 562.12
    n-methylformamide 296.39
    2-pentanol 646.48
    n-pentane 214.93
    1-propoxy-2-propanol 820.98
    1-methoxy-2-propyl acetate 784.6
    2-(2-methoxypropoxy) propanol 369.51
    mesitylene 211.58
    ε-caprolactone 1022.39
    p-cymene 176.46
    epichlorohydrin 1789.58
    1,1,1-trichloroethane 1301.7
    2-aminoethanol 159.72
    morpholine-4-carbaldehyde 734.15
    sulfolane 1260.52
    2,2,4-trimethylpentane 77.99
    2-methyltetrahydrofuran 2009.22
    n-hexyl acetate 570.57
    isooctane 75.67
    2-(2-butoxyethoxy)ethanol 543.11
    sec-butyl acetate 668.92
    tert-butyl acetate 897.03
    decalin 142.11
    glycerin 118.52
    diglyme 1131.9
    acrylic acid 168.24
    isopropyl myristate 214.63
    n-butyric acid 792.43
    acetyl acetate 459.13
    di(2-ethylhexyl) phthalate 140.98
    ethyl propionate 777.63
    nitromethane 579.76
    1,2-diethoxyethane 1483.1
    benzonitrile 398.47
    trioctyl phosphate 112.18
    1-bromopropane 1531.2
    gamma-valerolactone 1411.54
    n-decanol 120.99
    triethyl phosphate 237.08
    4-methyl-2-pentanol 334.73
    propionitrile 568.72
    vinylene carbonate 387.25
    1,1,2-trichlorotrifluoroethane 741.32
    DMS 326.38
    cumene 175.59
    2-octanol 149.23
    2-hexanone 1110.86
    octyl acetate 233.5
    limonene 358.12
    1,2-dimethoxyethane 1364.23
    ethyl orthosilicate 260.45
    tributyl phosphate 160.74
    diacetone alcohol 725.59
    N,N-dimethylaniline 285.34
    acrylonitrile 457.06
    aniline 392.69
    1,3-propanediol 301.55
    bromobenzene 601.67
    dibromomethane 1538.95
    1,1,2,2-tetrachloroethane 1880.03
    2-methyl-cyclohexyl acetate 473.0
    tetrabutyl urea 208.3
    diisobutyl methanol 296.38
    2-phenylethanol 345.19
    styrene 358.75
    dioctyl adipate 294.11
    dimethyl sulfate 228.68
    ethyl butyrate 830.12
    methyl lactate 186.72
    butyl lactate 309.49
    diethyl carbonate 378.39
    propanediol butyl ether 282.68
    triethyl orthoformate 478.42
    p-tert-butyltoluene 169.17
    methyl 4-tert-butylbenzoate 297.14
    morpholine 1873.48
    tert-butylamine 678.02
    n-dodecanol 91.78
    dimethoxymethane 877.84
    ethylene carbonate 385.14
    cyrene 278.72
    2-ethoxyethyl acetate 652.51
    2-ethylhexyl acetate 725.6
    1,2,4-trichlorobenzene 502.28
    4-methylpyridine 959.55
    dibutyl ether 714.63
    2,6-dimethyl-4-heptanol 296.38
    DEF 1050.43
    dimethyl isosorbide 676.88
    tetrachloroethylene 1105.87
    eugenol 262.77
    triacetin 409.81
    span 80 320.41
    1,4-butanediol 112.39
    1,1-dichloroethane 1624.18
    2-methyl-1-pentanol 510.02
    methyl formate 170.05
    2-methyl-1-butanol 590.75
    n-decane 51.96
    butyronitrile 810.89
    3,7-dimethyl-1-octanol 259.68
    1-chlorooctane 226.32
    1-chlorotetradecane 69.67
    n-nonane 57.88
    undecane 33.56
    tert-butylcyclohexane 121.97
    cyclooctane 133.02
    cyclopentanol 550.54
    tetrahydropyran 2494.34
    tert-amyl methyl ether 802.33
    2,5,8-trioxanonane 649.42
    1-hexene 953.81
    2-isopropoxyethanol 516.42
    2,2,2-trifluoroethanol 58.57
    methyl butyrate 1023.14

    Scent© AI

1 of 3
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