Ast7NQ1gie

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  • Identifiers

    CAS number
    118026-67-8

    Molecular formula
    C12H20O2

    SMILES
    CCCCC/C=C/C=C/COC(=O)C

    Safety labels

  • Odor profile

    Fragrance
    Fatty 80.35%
    Fruity 77.02%
    Green 67.38%
    Waxy 62.59%
    Pear 62.58%
    Melon 58.16%
    Oily 46.88%
    Citrus 46.47%
    Tropical 40.59%
    Fresh 40.36%

     

    Flavor
    Green 51.87%
    Waxy 44.27%
    Melon 38.44%
    Floral 35.62%
    Fatty 35.45%
    Sweet 34.4%
    Fresh 34.3%
    Oily 33.67%
    Pear 32.63%
    Fruity 31.8%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    3.7

    pKa est.
    8.51 (weak base)

    Molecular weight
    196.29 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    251°C

    Flash point

    • 120.38 ˚C est.

  • Synonyms

    • AST7NQ1GIE
    • Fema No. 4844
    • UNII-AST7NQ1GIE
    • trans, trans-2,4-Decadien-1-yl acetate
    • 2,4-Decadien-1-ol acetate, (2E,4E)-
    • 118026-67-8
    • SCHEMBL21112081
    • 118026-67-8

  • Applications

    Ast7NQ1gie (CAS 118026-67-8) is an industrial chemical that may serve as an intermediate in organic synthesis and may function as a solvent or processing aid. In practical use, it is commonly evaluated for applications in coatings and inks, plastics and polymer processing, and cleaning formulations, where it can act as a solvent or carrier for other components; it may also serve as a specialty additive such as a chelating agent or a surfactant in tailored formulations. The exact role and regulatory acceptability are case-specific and subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1432.89
    methanol 1462.74
    isopropanol 933.32
    water 0.07
    ethyl acetate 781.99
    n-propanol 905.62
    acetone 1313.78
    n-butanol 764.63
    acetonitrile 661.24
    DMF 1091.58
    toluene 322.18
    isobutanol 561.58
    1,4-dioxane 1195.91
    methyl acetate 577.58
    THF 1797.3
    2-butanone 874.19
    n-pentanol 636.89
    sec-butanol 724.9
    n-hexane 149.28
    ethylene glycol 133.82
    NMP 739.93
    cyclohexane 143.94
    DMSO 1979.75
    n-butyl acetate 550.35
    n-octanol 158.4
    chloroform 1520.42
    n-propyl acetate 505.31
    acetic acid 599.83
    dichloromethane 1451.89
    cyclohexanone 1021.11
    propylene glycol 332.62
    isopropyl acetate 475.05
    DMAc 910.86
    2-ethoxyethanol 833.57
    isopentanol 593.96
    n-heptane 43.68
    ethyl formate 292.76
    1,2-dichloroethane 1056.15
    n-hexanol 507.79
    2-methoxyethanol 1182.8
    isobutyl acetate 330.45
    tetrachloromethane 176.83
    n-pentyl acetate 257.98
    transcutol 2694.21
    n-heptanol 143.96
    ethylbenzene 171.65
    MIBK 437.3
    2-propoxyethanol 772.71
    tert-butanol 1039.45
    MTBE 938.79
    2-butoxyethanol 326.66
    propionic acid 443.46
    o-xylene 179.78
    formic acid 141.92
    diethyl ether 1109.28
    m-xylene 208.48
    p-xylene 196.53
    chlorobenzene 353.53
    dimethyl carbonate 151.05
    n-octane 14.89
    formamide 219.06
    cyclopentanone 1009.36
    2-pentanone 794.38
    anisole 386.16
    cyclopentyl methyl ether 866.69
    gamma-butyrolactone 834.74
    1-methoxy-2-propanol 891.5
    pyridine 884.17
    3-pentanone 500.36
    furfural 604.08
    n-dodecane 11.64
    diethylene glycol 477.21
    diisopropyl ether 223.39
    tert-amyl alcohol 811.02
    acetylacetone 716.21
    n-hexadecane 13.68
    acetophenone 326.13
    methyl propionate 509.65
    isopentyl acetate 501.81
    trichloroethylene 1491.77
    n-nonanol 141.14
    cyclohexanol 647.4
    benzyl alcohol 323.61
    2-ethylhexanol 281.31
    isooctanol 128.4
    dipropyl ether 379.36
    1,2-dichlorobenzene 310.73
    ethyl lactate 195.08
    propylene carbonate 416.36
    n-methylformamide 409.41
    2-pentanol 497.35
    n-pentane 77.32
    1-propoxy-2-propanol 566.32
    1-methoxy-2-propyl acetate 513.15
    2-(2-methoxypropoxy) propanol 411.87
    mesitylene 132.72
    ε-caprolactone 730.96
    p-cymene 94.29
    epichlorohydrin 1232.51
    1,1,1-trichloroethane 763.79
    2-aminoethanol 409.34
    morpholine-4-carbaldehyde 750.06
    sulfolane 1138.19
    2,2,4-trimethylpentane 45.67
    2-methyltetrahydrofuran 1349.07
    n-hexyl acetate 384.94
    isooctane 34.09
    2-(2-butoxyethoxy)ethanol 564.8
    sec-butyl acetate 356.74
    tert-butyl acetate 550.71
    decalin 74.97
    glycerin 322.72
    diglyme 955.48
    acrylic acid 290.49
    isopropyl myristate 141.62
    n-butyric acid 697.36
    acetyl acetate 364.18
    di(2-ethylhexyl) phthalate 139.29
    ethyl propionate 405.13
    nitromethane 833.38
    1,2-diethoxyethane 807.2
    benzonitrile 345.81
    trioctyl phosphate 90.0
    1-bromopropane 777.41
    gamma-valerolactone 1044.71
    n-decanol 101.32
    triethyl phosphate 155.21
    4-methyl-2-pentanol 249.41
    propionitrile 495.34
    vinylene carbonate 329.05
    1,1,2-trichlorotrifluoroethane 811.82
    DMS 294.4
    cumene 116.89
    2-octanol 105.18
    2-hexanone 585.36
    octyl acetate 170.83
    limonene 175.69
    1,2-dimethoxyethane 1101.96
    ethyl orthosilicate 161.97
    tributyl phosphate 136.42
    diacetone alcohol 562.97
    N,N-dimethylaniline 255.61
    acrylonitrile 479.25
    aniline 444.57
    1,3-propanediol 533.52
    bromobenzene 406.07
    dibromomethane 1076.97
    1,1,2,2-tetrachloroethane 1381.14
    2-methyl-cyclohexyl acetate 296.54
    tetrabutyl urea 177.9
    diisobutyl methanol 147.35
    2-phenylethanol 304.03
    styrene 244.98
    dioctyl adipate 231.72
    dimethyl sulfate 270.15
    ethyl butyrate 358.13
    methyl lactate 238.43
    butyl lactate 221.65
    diethyl carbonate 213.89
    propanediol butyl ether 357.65
    triethyl orthoformate 245.92
    p-tert-butyltoluene 95.17
    methyl 4-tert-butylbenzoate 253.7
    morpholine 1754.87
    tert-butylamine 618.28
    n-dodecanol 75.23
    dimethoxymethane 751.43
    ethylene carbonate 286.74
    cyrene 318.03
    2-ethoxyethyl acetate 402.37
    2-ethylhexyl acetate 370.56
    1,2,4-trichlorobenzene 379.83
    4-methylpyridine 804.62
    dibutyl ether 327.89
    2,6-dimethyl-4-heptanol 147.35
    DEF 726.82
    dimethyl isosorbide 597.66
    tetrachloroethylene 770.93
    eugenol 262.01
    triacetin 378.16
    span 80 345.62
    1,4-butanediol 223.77
    1,1-dichloroethane 950.01
    2-methyl-1-pentanol 527.54
    methyl formate 224.69
    2-methyl-1-butanol 576.44
    n-decane 21.22
    butyronitrile 566.6
    3,7-dimethyl-1-octanol 191.91
    1-chlorooctane 117.16
    1-chlorotetradecane 43.08
    n-nonane 21.85
    undecane 15.18
    tert-butylcyclohexane 69.16
    cyclooctane 37.07
    cyclopentanol 566.02
    tetrahydropyran 1518.99
    tert-amyl methyl ether 606.61
    2,5,8-trioxanonane 676.21
    1-hexene 549.32
    2-isopropoxyethanol 570.79
    2,2,2-trifluoroethanol 111.67
    methyl butyrate 528.38

    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