Propan-2-yl pent-2-enoate

  • Identifiers

    Molecular formula
    C8H14O2

    SMILES
    CCC=CC(=O)OC(C)C

  • Odor profile

    Fragrance
    Fruity 96.99%
    Green 69.21%
    Apple 66.83%
    Pineapple 59.32%
    Tropical 51.8%
    Ethereal 45.4%
    Banana 44.64%
    Sweet 43.28%
    Pear 37.39%
    Berry 37.0%

     

    Flavor
    Fruity 67.37%
    Tropical 36.29%
    Sweet 34.19%
    Berry 30.14%
    Green 27.5%
    Pineapple 27.43%
    Cheese 26.53%
    Ethereal 24.17%
    Pungent 23.75%
    Butter 22.2%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    2.2

    pKa est.
    8.36 (weak base)

    Molecular weight
    142.2 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very fast

    Boiling point est.
    162°C

    Flash point

    • 47.74 ˚C est.

  • Applications

    Propan-2-yl pent-2-enoate is used as a fragrance ingredient and a fixative in perfumery, as a solvent or co-solvent in cosmetics and personal care, and as a plasticizer or solvent in coatings and inks. It is also regarded as an industrial intermediate and may be explored as a monomer or comonomer for specialty polymers.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 874.5
    methanol 1100.26
    isopropanol 851.16
    water 2.29
    ethyl acetate 371.88
    n-propanol 735.42
    acetone 685.21
    n-butanol 738.5
    acetonitrile 429.57
    DMF 1182.4
    toluene 286.44
    isobutanol 596.57
    1,4-dioxane 880.13
    methyl acetate 369.31
    THF 1236.02
    2-butanone 472.76
    n-pentanol 506.23
    sec-butanol 730.3
    n-hexane 323.29
    ethylene glycol 219.13
    NMP 1040.46
    cyclohexane 385.41
    DMSO 767.05
    n-butyl acetate 422.76
    n-octanol 354.68
    chloroform 1618.61
    n-propyl acetate 226.76
    acetic acid 937.69
    dichloromethane 1016.83
    cyclohexanone 847.13
    propylene glycol 351.25
    isopropyl acetate 262.67
    DMAc 871.6
    2-ethoxyethanol 392.96
    isopentanol 607.82
    n-heptane 137.17
    ethyl formate 283.9
    1,2-dichloroethane 585.88
    n-hexanol 710.1
    2-methoxyethanol 742.95
    isobutyl acetate 180.33
    tetrachloromethane 251.3
    n-pentyl acetate 256.09
    transcutol 977.27
    n-heptanol 259.06
    ethylbenzene 203.13
    MIBK 275.63
    2-propoxyethanol 703.41
    tert-butanol 982.07
    MTBE 571.47
    2-butoxyethanol 320.58
    propionic acid 561.62
    o-xylene 204.14
    formic acid 249.02
    diethyl ether 490.51
    m-xylene 206.59
    p-xylene 258.51
    chlorobenzene 411.64
    dimethyl carbonate 159.45
    n-octane 57.43
    formamide 218.6
    cyclopentanone 829.15
    2-pentanone 421.73
    anisole 307.76
    cyclopentyl methyl ether 588.4
    gamma-butyrolactone 844.81
    1-methoxy-2-propanol 622.32
    pyridine 669.69
    3-pentanone 315.72
    furfural 702.69
    n-dodecane 53.18
    diethylene glycol 469.51
    diisopropyl ether 177.35
    tert-amyl alcohol 790.24
    acetylacetone 401.73
    n-hexadecane 58.29
    acetophenone 279.01
    methyl propionate 320.27
    isopentyl acetate 397.15
    trichloroethylene 1132.53
    n-nonanol 292.31
    cyclohexanol 768.75
    benzyl alcohol 289.76
    2-ethylhexanol 380.42
    isooctanol 200.97
    dipropyl ether 307.15
    1,2-dichlorobenzene 368.84
    ethyl lactate 169.48
    propylene carbonate 522.17
    n-methylformamide 445.35
    2-pentanol 544.65
    n-pentane 225.23
    1-propoxy-2-propanol 512.77
    1-methoxy-2-propyl acetate 330.36
    2-(2-methoxypropoxy) propanol 393.85
    mesitylene 156.22
    ε-caprolactone 670.65
    p-cymene 149.11
    epichlorohydrin 764.18
    1,1,1-trichloroethane 676.44
    2-aminoethanol 398.67
    morpholine-4-carbaldehyde 761.02
    sulfolane 1038.04
    2,2,4-trimethylpentane 97.31
    2-methyltetrahydrofuran 888.53
    n-hexyl acetate 473.17
    isooctane 72.23
    2-(2-butoxyethoxy)ethanol 473.75
    sec-butyl acetate 181.8
    tert-butyl acetate 320.77
    decalin 142.77
    glycerin 380.49
    diglyme 644.1
    acrylic acid 500.01
    isopropyl myristate 190.95
    n-butyric acid 735.04
    acetyl acetate 269.25
    di(2-ethylhexyl) phthalate 206.49
    ethyl propionate 226.18
    nitromethane 718.29
    1,2-diethoxyethane 349.43
    benzonitrile 389.66
    trioctyl phosphate 157.19
    1-bromopropane 523.43
    gamma-valerolactone 868.83
    n-decanol 217.73
    triethyl phosphate 158.5
    4-methyl-2-pentanol 284.98
    propionitrile 400.51
    vinylene carbonate 487.43
    1,1,2-trichlorotrifluoroethane 683.9
    DMS 275.83
    cumene 152.05
    2-octanol 214.48
    2-hexanone 325.39
    octyl acetate 251.87
    limonene 254.56
    1,2-dimethoxyethane 700.71
    ethyl orthosilicate 156.38
    tributyl phosphate 184.35
    diacetone alcohol 386.02
    N,N-dimethylaniline 265.33
    acrylonitrile 419.9
    aniline 360.33
    1,3-propanediol 521.53
    bromobenzene 440.25
    dibromomethane 814.91
    1,1,2,2-tetrachloroethane 1073.75
    2-methyl-cyclohexyl acetate 272.15
    tetrabutyl urea 242.51
    diisobutyl methanol 203.36
    2-phenylethanol 352.74
    styrene 243.35
    dioctyl adipate 268.65
    dimethyl sulfate 268.08
    ethyl butyrate 243.47
    methyl lactate 246.97
    butyl lactate 239.67
    diethyl carbonate 194.8
    propanediol butyl ether 401.95
    triethyl orthoformate 202.97
    p-tert-butyltoluene 153.97
    methyl 4-tert-butylbenzoate 319.15
    morpholine 1002.6
    tert-butylamine 688.04
    n-dodecanol 174.08
    dimethoxymethane 492.96
    ethylene carbonate 395.34
    cyrene 308.23
    2-ethoxyethyl acetate 266.36
    2-ethylhexyl acetate 309.33
    1,2,4-trichlorobenzene 427.65
    4-methylpyridine 666.62
    dibutyl ether 324.73
    2,6-dimethyl-4-heptanol 203.36
    DEF 548.77
    dimethyl isosorbide 529.64
    tetrachloroethylene 663.25
    eugenol 311.18
    triacetin 343.91
    span 80 421.97
    1,4-butanediol 239.0
    1,1-dichloroethane 726.94
    2-methyl-1-pentanol 460.4
    methyl formate 325.72
    2-methyl-1-butanol 582.33
    n-decane 83.71
    butyronitrile 516.22
    3,7-dimethyl-1-octanol 325.36
    1-chlorooctane 244.2
    1-chlorotetradecane 109.56
    n-nonane 87.98
    undecane 64.1
    tert-butylcyclohexane 133.84
    cyclooctane 110.78
    cyclopentanol 775.74
    tetrahydropyran 987.54
    tert-amyl methyl ether 441.83
    2,5,8-trioxanonane 519.06
    1-hexene 539.26
    2-isopropoxyethanol 295.9
    2,2,2-trifluoroethanol 244.11
    methyl butyrate 313.3

    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