2-Methyl-2-butenyl isobutyrate

  • Identifiers

    SMILES
    CC=C(C)COC(=O)C(C)C

  • Odor profile

    Fruity 95.91%
    Apple 58.08%
    Green 56.88%
    Sweet 54.89%
    Tropical 50.14%
    Pineapple 44.3%
    Ethereal 41.86%
    Banana 41.0%
    Berry 39.77%
    Fresh 38.69%

    Scent© AI

  • Properties

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Fast

    Boiling point est.
    173°C

    Flash point est.
    63.91 ˚C

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1593.69
    methanol 1464.66
    isopropanol 1379.04
    water 5.88
    ethyl acetate 884.09
    n-propanol 1175.07
    acetone 839.01
    n-butanol 1351.77
    acetonitrile 1123.89
    DMF 695.59
    toluene 621.53
    isobutanol 1030.57
    1,4-dioxane 1579.99
    methyl acetate 831.85
    THF 1386.27
    2-butanone 949.74
    n-pentanol 1115.74
    sec-butanol 1505.83
    n-hexane 350.9
    ethylene glycol 155.61
    NMP 689.17
    cyclohexane 401.0
    DMSO 503.09
    n-butyl acetate 1014.83
    n-octanol 684.43
    chloroform 3245.19
    n-propyl acetate 765.1
    acetic acid 1209.51
    dichloromethane 2342.81
    cyclohexanone 1113.69
    propylene glycol 288.54
    isopropyl acetate 563.69
    DMAc 903.08
    2-ethoxyethanol 983.19
    isopentanol 1316.9
    n-heptane 176.4
    ethyl formate 696.25
    1,2-dichloroethane 1055.7
    n-hexanol 1136.99
    2-methoxyethanol 1077.53
    isobutyl acetate 498.18
    tetrachloromethane 693.39
    n-pentyl acetate 632.83
    transcutol 2167.38
    n-heptanol 692.48
    ethylbenzene 528.84
    MIBK 495.82
    2-propoxyethanol 1020.23
    tert-butanol 1866.97
    MTBE 1524.14
    2-butoxyethanol 843.18
    propionic acid 719.69
    o-xylene 451.97
    formic acid 391.18
    diethyl ether 1006.05
    m-xylene 404.22
    p-xylene 854.42
    chlorobenzene 765.84
    dimethyl carbonate 157.37
    n-octane 92.72
    formamide 524.37
    cyclopentanone 864.52
    2-pentanone 721.0
    anisole 793.71
    cyclopentyl methyl ether 666.69
    gamma-butyrolactone 847.17
    1-methoxy-2-propanol 740.39
    pyridine 1328.04
    3-pentanone 494.74
    furfural 1047.05
    n-dodecane 68.2
    diethylene glycol 498.37
    diisopropyl ether 354.48
    tert-amyl alcohol 1997.45
    acetylacetone 574.07
    n-hexadecane 75.0
    acetophenone 684.82
    methyl propionate 458.78
    isopentyl acetate 953.59
    trichloroethylene 2297.12
    n-nonanol 594.26
    cyclohexanol 1031.76
    benzyl alcohol 689.04
    2-ethylhexanol 787.96
    isooctanol 565.7
    dipropyl ether 529.55
    1,2-dichlorobenzene 665.94
    ethyl lactate 271.99
    propylene carbonate 645.49
    n-methylformamide 494.35
    2-pentanol 1030.66
    n-pentane 265.96
    1-propoxy-2-propanol 784.85
    1-methoxy-2-propyl acetate 501.62
    2-(2-methoxypropoxy) propanol 637.1
    mesitylene 267.53
    ε-caprolactone 1088.86
    p-cymene 328.49
    epichlorohydrin 1191.03
    1,1,1-trichloroethane 1579.09
    2-aminoethanol 454.64
    morpholine-4-carbaldehyde 953.88
    sulfolane 682.93
    2,2,4-trimethylpentane 180.81
    2-methyltetrahydrofuran 1421.61
    n-hexyl acetate 911.08
    isooctane 118.48
    2-(2-butoxyethoxy)ethanol 849.5
    sec-butyl acetate 567.68
    tert-butyl acetate 583.74
    decalin 215.38
    glycerin 295.06
    diglyme 1414.43
    acrylic acid 543.73
    isopropyl myristate 317.99
    n-butyric acid 1198.98
    acetyl acetate 495.32
    di(2-ethylhexyl) phthalate 307.08
    ethyl propionate 536.85
    nitromethane 1107.81
    1,2-diethoxyethane 935.66
    benzonitrile 975.14
    trioctyl phosphate 219.18
    1-bromopropane 918.8
    gamma-valerolactone 1194.33
    n-decanol 406.29
    triethyl phosphate 267.63
    4-methyl-2-pentanol 606.8
    propionitrile 886.29
    vinylene carbonate 657.84
    1,1,2-trichlorotrifluoroethane 887.2
    DMS 369.63
    cumene 393.34
    2-octanol 543.83
    2-hexanone 829.7
    octyl acetate 414.14
    limonene 480.46
    1,2-dimethoxyethane 1540.03
    ethyl orthosilicate 308.65
    tributyl phosphate 262.09
    diacetone alcohol 629.11
    N,N-dimethylaniline 556.37
    acrylonitrile 858.36
    aniline 694.01
    1,3-propanediol 763.3
    bromobenzene 815.85
    dibromomethane 1696.18
    1,1,2,2-tetrachloroethane 1917.37
    2-methyl-cyclohexyl acetate 547.18
    tetrabutyl urea 305.47
    diisobutyl methanol 384.44
    2-phenylethanol 678.89
    styrene 626.16
    dioctyl adipate 410.76
    dimethyl sulfate 190.51
    ethyl butyrate 652.04
    methyl lactate 217.9
    butyl lactate 421.67
    diethyl carbonate 438.24
    propanediol butyl ether 647.32
    triethyl orthoformate 436.31
    p-tert-butyltoluene 307.36
    methyl 4-tert-butylbenzoate 507.77
    morpholine 1762.68
    tert-butylamine 1497.79
    n-dodecanol 289.31
    dimethoxymethane 449.26
    ethylene carbonate 542.61
    cyrene 465.52
    2-ethoxyethyl acetate 637.08
    2-ethylhexyl acetate 778.8
    1,2,4-trichlorobenzene 771.21
    4-methylpyridine 1423.64
    dibutyl ether 653.1
    2,6-dimethyl-4-heptanol 384.44
    DEF 740.4
    dimethyl isosorbide 761.83
    tetrachloroethylene 1301.03
    eugenol 565.33
    triacetin 538.58
    span 80 621.87
    1,4-butanediol 380.14
    1,1-dichloroethane 1509.16
    2-methyl-1-pentanol 1206.45
    methyl formate 332.24
    2-methyl-1-butanol 1270.19
    n-decane 122.06
    butyronitrile 1229.99
    3,7-dimethyl-1-octanol 646.2
    1-chlorooctane 405.51
    1-chlorotetradecane 153.7
    n-nonane 122.27
    undecane 86.31
    tert-butylcyclohexane 221.86
    cyclooctane 117.55
    cyclopentanol 806.89
    tetrahydropyran 1571.26
    tert-amyl methyl ether 1063.67
    2,5,8-trioxanonane 841.68
    1-hexene 901.99
    2-isopropoxyethanol 745.9
    2,2,2-trifluoroethanol 334.07
    methyl butyrate 841.32

    Scent© AI

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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
Name CAS Botanical Proportion
Roman chamomile (Germany) 1a hydrodistillate 8015-92-7 Anthemis nobilis L., fam. Asteraceae (Compositae) 0.15%