Trideca-5,8-dienal

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  • Identifiers

    CAS number
    60671-77-4

    Molecular formula
    C13H22O

    SMILES
    CCCCC=CCC=CCCCC=O

  • Odor profile

    Fatty 73.03%
    Citrus 59.75%
    Waxy 47.64%
    Fruity 42.66%
    Oily 40.48%
    Aldehydic 39.65%
    Herbal 35.43%
    Green 34.91%
    Fresh 33.19%
    Orange 32.99%

    Scent© AI

  • Properties

    XLogP3-AA
    3.8

    Molecular weight
    194.31 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very slow

    Boiling point est.
    252°C

    Flash point est.
    131.5 ˚C

  • Applications

    Trideca-5,8-dienal (CAS 60671-77-4) is an unsaturated linear aldehyde used primarily as a fragrance ingredient to impart crisp aldehydic, green, slightly fatty–marine and citrus-peel nuances, boosting top notes and diffusion in fine fragrances, personal care and household products; in flavor applications it is dosed at trace levels to evoke cucumber/green-leaf, tropical-fruit or seafood facets in soups, seasonings, beverages and snacks; it is also employed as a reference/marker in studies of lipid oxidation and natural aroma formation, and as a versatile synthetic intermediate for building polyenes, aroma derivatives and functional materials, leveraging its reactive aldehyde function and two modifiable double bonds.

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1581.55
    methanol 1348.33
    isopropanol 1411.65
    water 0.02
    ethyl acetate 1860.86
    n-propanol 1365.26
    acetone 2315.65
    n-butanol 1363.26
    acetonitrile 895.26
    DMF 985.55
    toluene 646.41
    isobutanol 900.01
    1,4-dioxane 1754.41
    methyl acetate 991.69
    THF 3064.25
    2-butanone 1805.03
    n-pentanol 1008.37
    sec-butanol 1181.06
    n-hexane 724.67
    ethylene glycol 78.14
    NMP 754.09
    cyclohexane 782.53
    DMSO 2254.93
    n-butyl acetate 1625.95
    n-octanol 303.8
    chloroform 2261.14
    n-propyl acetate 1411.46
    acetic acid 568.79
    dichloromethane 2759.18
    cyclohexanone 2094.02
    propylene glycol 205.72
    isopropyl acetate 1084.04
    DMAc 702.73
    2-ethoxyethanol 917.98
    isopentanol 1167.81
    n-heptane 317.29
    ethyl formate 540.55
    1,2-dichloroethane 2284.98
    n-hexanol 1084.16
    2-methoxyethanol 1319.38
    isobutyl acetate 761.13
    tetrachloromethane 423.97
    n-pentyl acetate 708.31
    transcutol 3713.38
    n-heptanol 329.41
    ethylbenzene 380.29
    MIBK 983.11
    2-propoxyethanol 1202.27
    tert-butanol 1502.72
    MTBE 1745.51
    2-butoxyethanol 577.15
    propionic acid 555.79
    o-xylene 321.77
    formic acid 77.52
    diethyl ether 2819.23
    m-xylene 407.01
    p-xylene 401.64
    chlorobenzene 692.79
    dimethyl carbonate 178.05
    n-octane 81.78
    formamide 145.3
    cyclopentanone 1746.51
    2-pentanone 1920.18
    anisole 580.88
    cyclopentyl methyl ether 1743.13
    gamma-butyrolactone 1364.2
    1-methoxy-2-propanol 1204.15
    pyridine 1452.5
    3-pentanone 1084.72
    furfural 898.77
    n-dodecane 38.79
    diethylene glycol 477.93
    diisopropyl ether 658.52
    tert-amyl alcohol 1075.47
    acetylacetone 1193.29
    n-hexadecane 46.4
    acetophenone 522.43
    methyl propionate 947.87
    isopentyl acetate 1265.62
    trichloroethylene 2734.53
    n-nonanol 276.6
    cyclohexanol 1085.02
    benzyl alcohol 450.33
    2-ethylhexanol 718.87
    isooctanol 314.41
    dipropyl ether 1539.84
    1,2-dichlorobenzene 591.62
    ethyl lactate 297.67
    propylene carbonate 732.64
    n-methylformamide 434.56
    2-pentanol 1086.03
    n-pentane 424.18
    1-propoxy-2-propanol 1135.61
    1-methoxy-2-propyl acetate 954.37
    2-(2-methoxypropoxy) propanol 493.11
    mesitylene 276.81
    ε-caprolactone 1375.04
    p-cymene 229.93
    epichlorohydrin 2010.01
    1,1,1-trichloroethane 1638.17
    2-aminoethanol 289.21
    morpholine-4-carbaldehyde 913.05
    sulfolane 1466.02
    2,2,4-trimethylpentane 119.81
    2-methyltetrahydrofuran 2611.92
    n-hexyl acetate 786.23
    isooctane 113.63
    2-(2-butoxyethoxy)ethanol 736.75
    sec-butyl acetate 844.84
    tert-butyl acetate 1039.45
    decalin 215.86
    glycerin 204.56
    diglyme 1466.16
    acrylic acid 293.66
    isopropyl myristate 290.47
    n-butyric acid 1278.71
    acetyl acetate 625.74
    di(2-ethylhexyl) phthalate 190.01
    ethyl propionate 988.79
    nitromethane 892.78
    1,2-diethoxyethane 1927.48
    benzonitrile 598.77
    trioctyl phosphate 152.51
    1-bromopropane 2080.8
    gamma-valerolactone 1725.55
    n-decanol 197.49
    triethyl phosphate 291.13
    4-methyl-2-pentanol 510.58
    propionitrile 965.31
    vinylene carbonate 544.38
    1,1,2-trichlorotrifluoroethane 945.97
    DMS 414.25
    cumene 233.91
    2-octanol 238.59
    2-hexanone 1458.21
    octyl acetate 319.88
    limonene 464.52
    1,2-dimethoxyethane 1807.16
    ethyl orthosilicate 317.69
    tributyl phosphate 220.27
    diacetone alcohol 843.31
    N,N-dimethylaniline 357.0
    acrylonitrile 756.41
    aniline 626.55
    1,3-propanediol 532.31
    bromobenzene 816.03
    dibromomethane 2241.26
    1,1,2,2-tetrachloroethane 2213.63
    2-methyl-cyclohexyl acetate 582.49
    tetrabutyl urea 275.89
    diisobutyl methanol 416.3
    2-phenylethanol 479.94
    styrene 514.91
    dioctyl adipate 381.98
    dimethyl sulfate 269.09
    ethyl butyrate 1075.63
    methyl lactate 249.33
    butyl lactate 414.57
    diethyl carbonate 497.72
    propanediol butyl ether 426.48
    triethyl orthoformate 609.14
    p-tert-butyltoluene 218.33
    methyl 4-tert-butylbenzoate 363.83
    morpholine 2481.54
    tert-butylamine 1119.97
    n-dodecanol 147.86
    dimethoxymethane 1076.23
    ethylene carbonate 523.05
    cyrene 347.46
    2-ethoxyethyl acetate 794.94
    2-ethylhexyl acetate 956.98
    1,2,4-trichlorobenzene 612.65
    4-methylpyridine 1348.96
    dibutyl ether 1050.82
    2,6-dimethyl-4-heptanol 416.3
    DEF 1384.35
    dimethyl isosorbide 795.63
    tetrachloroethylene 1427.86
    eugenol 339.87
    triacetin 547.01
    span 80 450.96
    1,4-butanediol 201.86
    1,1-dichloroethane 2167.19
    2-methyl-1-pentanol 807.84
    methyl formate 252.78
    2-methyl-1-butanol 966.5
    n-decane 84.11
    butyronitrile 1340.94
    3,7-dimethyl-1-octanol 391.07
    1-chlorooctane 331.41
    1-chlorotetradecane 103.13
    n-nonane 99.15
    undecane 54.13
    tert-butylcyclohexane 190.48
    cyclooctane 203.05
    cyclopentanol 842.82
    tetrahydropyran 3407.69
    tert-amyl methyl ether 1054.36
    2,5,8-trioxanonane 839.73
    1-hexene 1725.91
    2-isopropoxyethanol 712.94
    2,2,2-trifluoroethanol 97.87
    methyl butyrate 1334.71

    Scent© AI

1 3

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
Cilantro (Coriander leaf) 1 8008-52-4 Coriandrum sativum L., fam. Apiaceae (Umbelliferae) 5.61%