Butyl undec-2-enoate

  • Identifiers

    Molecular formula
    C15H28O2

    SMILES
    CCCCCCCCC=CC(=O)OCCCC

  • Odor profile

    Fragrance
    Fatty 78.23%
    Fruity 75.67%
    Green 67.21%
    Waxy 66.09%
    Oily 56.89%
    Pear 49.64%
    Winey 39.02%
    Melon 38.77%
    Dairy 36.44%
    Cognac 33.09%

     

    Flavor
    Fruity 71.54%
    Waxy 64.99%
    Green 55.3%
    Pear 41.4%
    Oily 40.84%
    Fatty 37.65%
    Apple 36.46%
    Sweet 35.2%
    Tropical 33.03%
    Creamy 31.73%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    5.9

    pKa est.
    7.06 (neutral)

    Molecular weight
    240.38 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    296°C

    Flash point

    • 131.28 ˚C est.

  • Synonyms

    • SCHEMBL858499
  • Applications

    Butyl undec-2-enoate is used as a fragrance ingredient and fixative in perfumery, and is evaluated for inclusion in cosmetics and personal care formulations. It is also used as an additive in coatings and inks, may act as a plasticizer or auxiliary additive in polymers/plastics, and may appear in cleaning and household product formulations as a solvent or auxiliary component, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 7228.34
    methanol 6218.7
    isopropanol 6878.52
    water 0.03
    ethyl acetate 8661.7
    n-propanol 6369.65
    acetone 13923.32
    n-butanol 5760.23
    acetonitrile 5691.29
    DMF 7704.56
    toluene 3081.95
    isobutanol 5046.2
    1,4-dioxane 6635.8
    methyl acetate 5106.52
    THF 11268.53
    2-butanone 9395.65
    n-pentanol 3576.51
    sec-butanol 6214.33
    n-hexane 1969.03
    ethylene glycol 213.4
    NMP 5471.16
    cyclohexane 3580.53
    DMSO 8855.18
    n-butyl acetate 6132.0
    n-octanol 1227.88
    chloroform 9813.68
    n-propyl acetate 5804.38
    acetic acid 2904.95
    dichloromethane 11554.96
    cyclohexanone 12777.18
    propylene glycol 644.64
    isopropyl acetate 5351.81
    DMAc 4965.34
    2-ethoxyethanol 3059.12
    isopentanol 4885.57
    n-heptane 665.73
    ethyl formate 3059.86
    1,2-dichloroethane 10470.64
    n-hexanol 3037.6
    2-methoxyethanol 4961.63
    isobutyl acetate 2833.75
    tetrachloromethane 1721.78
    n-pentyl acetate 3487.92
    transcutol 9170.1
    n-heptanol 1179.47
    ethylbenzene 1537.41
    MIBK 4307.88
    2-propoxyethanol 3488.94
    tert-butanol 6691.08
    MTBE 8992.05
    2-butoxyethanol 2010.29
    propionic acid 2726.6
    o-xylene 1513.35
    formic acid 371.78
    diethyl ether 10330.67
    m-xylene 1704.63
    p-xylene 1928.83
    chlorobenzene 3614.29
    dimethyl carbonate 995.86
    n-octane 236.77
    formamide 874.49
    cyclopentanone 9374.24
    2-pentanone 9674.19
    anisole 2329.76
    cyclopentyl methyl ether 7400.42
    gamma-butyrolactone 7353.86
    1-methoxy-2-propanol 4193.2
    pyridine 7553.66
    3-pentanone 5245.36
    furfural 4373.82
    n-dodecane 115.07
    diethylene glycol 1375.59
    diisopropyl ether 2585.54
    tert-amyl alcohol 5707.44
    acetylacetone 5687.72
    n-hexadecane 143.47
    acetophenone 2216.52
    methyl propionate 4778.6
    isopentyl acetate 4787.31
    trichloroethylene 13490.35
    n-nonanol 1044.91
    cyclohexanol 6020.29
    benzyl alcohol 1676.54
    2-ethylhexanol 2081.26
    isooctanol 1069.61
    dipropyl ether 3756.3
    1,2-dichlorobenzene 2878.03
    ethyl lactate 1139.19
    propylene carbonate 3618.21
    n-methylformamide 3063.5
    2-pentanol 4799.46
    n-pentane 1365.41
    1-propoxy-2-propanol 3238.0
    1-methoxy-2-propyl acetate 3438.66
    2-(2-methoxypropoxy) propanol 1478.28
    mesitylene 1037.22
    ε-caprolactone 7718.61
    p-cymene 755.29
    epichlorohydrin 9109.98
    1,1,1-trichloroethane 8387.73
    2-aminoethanol 1068.02
    morpholine-4-carbaldehyde 4253.98
    sulfolane 7421.04
    2,2,4-trimethylpentane 410.3
    2-methyltetrahydrofuran 11741.1
    n-hexyl acetate 3770.08
    isooctane 337.32
    2-(2-butoxyethoxy)ethanol 2321.41
    sec-butyl acetate 3758.06
    tert-butyl acetate 4551.77
    decalin 768.11
    glycerin 590.52
    diglyme 4590.38
    acrylic acid 1471.77
    isopropyl myristate 1066.2
    n-butyric acid 6237.4
    acetyl acetate 3047.77
    di(2-ethylhexyl) phthalate 716.13
    ethyl propionate 4532.81
    nitromethane 5749.87
    1,2-diethoxyethane 5251.89
    benzonitrile 2769.78
    trioctyl phosphate 568.18
    1-bromopropane 8488.54
    gamma-valerolactone 9078.78
    n-decanol 668.11
    triethyl phosphate 929.84
    4-methyl-2-pentanol 1987.39
    propionitrile 4660.8
    vinylene carbonate 2712.7
    1,1,2-trichlorotrifluoroethane 3943.12
    DMS 1864.18
    cumene 843.02
    2-octanol 1048.31
    2-hexanone 5721.26
    octyl acetate 1317.15
    limonene 1663.46
    1,2-dimethoxyethane 6240.46
    ethyl orthosilicate 965.19
    tributyl phosphate 834.09
    diacetone alcohol 3423.76
    N,N-dimethylaniline 1422.16
    acrylonitrile 4050.04
    aniline 2828.06
    1,3-propanediol 2088.54
    bromobenzene 4198.19
    dibromomethane 8891.33
    1,1,2,2-tetrachloroethane 10845.29
    2-methyl-cyclohexyl acetate 1956.44
    tetrabutyl urea 1099.36
    diisobutyl methanol 1117.94
    2-phenylethanol 1577.86
    styrene 2212.55
    dioctyl adipate 1405.14
    dimethyl sulfate 1380.99
    ethyl butyrate 3641.05
    methyl lactate 1167.75
    butyl lactate 1792.86
    diethyl carbonate 1698.39
    propanediol butyl ether 1551.88
    triethyl orthoformate 1850.77
    p-tert-butyltoluene 703.95
    methyl 4-tert-butylbenzoate 1484.21
    morpholine 10772.1
    tert-butylamine 4724.92
    n-dodecanol 477.08
    dimethoxymethane 4655.46
    ethylene carbonate 2755.71
    cyrene 1117.6
    2-ethoxyethyl acetate 3229.16
    2-ethylhexyl acetate 3634.94
    1,2,4-trichlorobenzene 3063.75
    4-methylpyridine 7377.74
    dibutyl ether 3647.77
    2,6-dimethyl-4-heptanol 1117.94
    DEF 7840.14
    dimethyl isosorbide 2446.61
    tetrachloroethylene 6487.94
    eugenol 1275.3
    triacetin 2156.46
    span 80 1562.85
    1,4-butanediol 722.48
    1,1-dichloroethane 10337.51
    2-methyl-1-pentanol 3044.15
    methyl formate 1671.23
    2-methyl-1-butanol 4667.62
    n-decane 257.96
    butyronitrile 6686.81
    3,7-dimethyl-1-octanol 1359.4
    1-chlorooctane 1335.18
    1-chlorotetradecane 370.02
    n-nonane 290.98
    undecane 161.35
    tert-butylcyclohexane 591.06
    cyclooctane 694.12
    cyclopentanol 4841.39
    tetrahydropyran 14931.27
    tert-amyl methyl ether 5043.67
    2,5,8-trioxanonane 2475.17
    1-hexene 5618.31
    2-isopropoxyethanol 2419.47
    2,2,2-trifluoroethanol 572.53
    methyl butyrate 6593.83

    Scent© AI

1 of 4
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