(Z)-5-Octen-1-yl 3-methylbutanoate

Overview IFRA Request a quote

  • Identifiers

    Molecular formula
    C13H24O2

    SMILES
    CC/C=C\CCCCOC(=O)CC(C)C

  • Odor profile

    Fruity 84.8%
    Green 79.62%
    Apple 62.62%
    Tropical 56.15%
    Waxy 54.73%
    Pear 54.4%
    Herbal 46.33%
    Melon 42.48%
    Pineapple 41.27%
    Fatty 40.32%

    Scent© AI

  • Properties

    XLogP3-AA
    3.9

    Molecular weight
    212.33 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    248°C

    Flash point est.
    108.54 ˚C

  • Synonyms

    • (Z)-5-Octen-1-yl 3-methylbutanoate
    • ZWSJDKUYXLNKRR-WAYWQWQTSA-N
    • z-5-octen-1-yl 3-methylbutanoate
    • 5-Octen-1-ol, (Z)-, 3-methylbutanoate

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3543.19
    methanol 3086.35
    isopropanol 3675.71
    water 0.22
    ethyl acetate 2695.72
    n-propanol 2949.26
    acetone 4629.79
    n-butanol 3007.45
    acetonitrile 2443.03
    DMF 2792.59
    toluene 1239.26
    isobutanol 2593.28
    1,4-dioxane 3145.69
    methyl acetate 1789.38
    THF 5052.75
    2-butanone 2873.06
    n-pentanol 2176.62
    sec-butanol 3270.26
    n-hexane 1475.01
    ethylene glycol 222.7
    NMP 2370.96
    cyclohexane 1905.56
    DMSO 3060.62
    n-butyl acetate 2418.98
    n-octanol 1083.69
    chloroform 6654.3
    n-propyl acetate 1827.75
    acetic acid 2274.14
    dichloromethane 5301.71
    cyclohexanone 4968.24
    propylene glycol 590.33
    isopropyl acetate 1687.13
    DMAc 1781.14
    2-ethoxyethanol 1392.92
    isopentanol 2620.36
    n-heptane 518.19
    ethyl formate 1305.07
    1,2-dichloroethane 3577.62
    n-hexanol 2292.48
    2-methoxyethanol 2069.94
    isobutyl acetate 1142.04
    tetrachloromethane 1017.98
    n-pentyl acetate 1363.96
    transcutol 4556.11
    n-heptanol 870.29
    ethylbenzene 782.21
    MIBK 1604.16
    2-propoxyethanol 2015.61
    tert-butanol 3656.78
    MTBE 3239.02
    2-butoxyethanol 1096.23
    propionic acid 1633.06
    o-xylene 751.21
    formic acid 313.77
    diethyl ether 3317.36
    m-xylene 842.87
    p-xylene 1013.04
    chlorobenzene 1891.39
    dimethyl carbonate 435.85
    n-octane 201.7
    formamide 446.71
    cyclopentanone 3786.41
    2-pentanone 2903.18
    anisole 1122.32
    cyclopentyl methyl ether 2702.42
    gamma-butyrolactone 3234.34
    1-methoxy-2-propanol 1921.95
    pyridine 2845.46
    3-pentanone 1735.47
    furfural 2148.1
    n-dodecane 127.21
    diethylene glycol 912.25
    diisopropyl ether 1099.03
    tert-amyl alcohol 3000.73
    acetylacetone 2056.75
    n-hexadecane 150.5
    acetophenone 1025.56
    methyl propionate 1495.58
    isopentyl acetate 2012.38
    trichloroethylene 5598.36
    n-nonanol 872.42
    cyclohexanol 3201.63
    benzyl alcohol 940.31
    2-ethylhexanol 1292.65
    isooctanol 748.78
    dipropyl ether 1628.16
    1,2-dichlorobenzene 1508.22
    ethyl lactate 602.42
    propylene carbonate 1915.94
    n-methylformamide 1183.35
    2-pentanol 2550.94
    n-pentane 936.98
    1-propoxy-2-propanol 1775.38
    1-methoxy-2-propyl acetate 1429.33
    2-(2-methoxypropoxy) propanol 999.86
    mesitylene 606.7
    ε-caprolactone 3076.69
    p-cymene 482.49
    epichlorohydrin 3604.63
    1,1,1-trichloroethane 3836.95
    2-aminoethanol 770.67
    morpholine-4-carbaldehyde 1878.15
    sulfolane 3520.32
    2,2,4-trimethylpentane 315.57
    2-methyltetrahydrofuran 4310.79
    n-hexyl acetate 2046.1
    isooctane 269.92
    2-(2-butoxyethoxy)ethanol 1452.47
    sec-butyl acetate 1185.2
    tert-butyl acetate 1723.15
    decalin 501.64
    glycerin 555.15
    diglyme 2246.89
    acrylic acid 1062.83
    isopropyl myristate 708.58
    n-butyric acid 3171.44
    acetyl acetate 1229.94
    di(2-ethylhexyl) phthalate 525.29
    ethyl propionate 1329.46
    nitromethane 2600.08
    1,2-diethoxyethane 1881.6
    benzonitrile 1551.23
    trioctyl phosphate 424.48
    1-bromopropane 3107.22
    gamma-valerolactone 3499.66
    n-decanol 607.56
    triethyl phosphate 494.3
    4-methyl-2-pentanol 1144.96
    propionitrile 2005.35
    vinylene carbonate 1567.95
    1,1,2-trichlorotrifluoroethane 2098.12
    DMS 927.12
    cumene 532.25
    2-octanol 759.59
    2-hexanone 2135.99
    octyl acetate 889.69
    limonene 927.44
    1,2-dimethoxyethane 2648.99
    ethyl orthosilicate 513.95
    tributyl phosphate 560.86
    diacetone alcohol 1515.46
    N,N-dimethylaniline 758.65
    acrylonitrile 1720.79
    aniline 1367.49
    1,3-propanediol 1277.39
    bromobenzene 2130.32
    dibromomethane 4382.83
    1,1,2,2-tetrachloroethane 4930.3
    2-methyl-cyclohexyl acetate 1051.69
    tetrabutyl urea 708.07
    diisobutyl methanol 742.08
    2-phenylethanol 998.45
    styrene 986.89
    dioctyl adipate 892.53
    dimethyl sulfate 689.92
    ethyl butyrate 1355.66
    methyl lactate 609.09
    butyl lactate 943.26
    diethyl carbonate 788.37
    propanediol butyl ether 1216.58
    triethyl orthoformate 856.34
    p-tert-butyltoluene 464.25
    methyl 4-tert-butylbenzoate 904.93
    morpholine 4176.4
    tert-butylamine 2605.16
    n-dodecanol 455.27
    dimethoxymethane 1576.76
    ethylene carbonate 1467.24
    cyrene 785.91
    2-ethoxyethyl acetate 1274.02
    2-ethylhexyl acetate 1522.78
    1,2,4-trichlorobenzene 1641.73
    4-methylpyridine 2859.93
    dibutyl ether 1680.22
    2,6-dimethyl-4-heptanol 742.08
    DEF 2214.62
    dimethyl isosorbide 1477.34
    tetrachloroethylene 3030.58
    eugenol 823.66
    triacetin 1262.82
    span 80 1170.63
    1,4-butanediol 560.31
    1,1-dichloroethane 4369.33
    2-methyl-1-pentanol 1825.86
    methyl formate 810.0
    2-methyl-1-butanol 2399.72
    n-decane 251.63
    butyronitrile 3078.98
    3,7-dimethyl-1-octanol 1027.26
    1-chlorooctane 924.11
    1-chlorotetradecane 329.61
    n-nonane 287.5
    undecane 169.55
    tert-butylcyclohexane 437.43
    cyclooctane 452.04
    cyclopentanol 2756.29
    tetrahydropyran 5535.48
    tert-amyl methyl ether 2021.73
    2,5,8-trioxanonane 1469.19
    1-hexene 2898.94
    2-isopropoxyethanol 1109.61
    2,2,2-trifluoroethanol 459.05
    methyl butyrate 2029.71

    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