3-Nonenyl acetate, (3Z)-

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  • Identifiers

    CAS number
    13049-88-2

    Molecular formula
    C11H20O2

    SMILES
    CCCCC/C=C\CCOC(=O)C

  • Odor profile

    Fragrance
    Fruity 82.54%
    Green 80.86%
    Waxy 71.5%
    Fatty 71.16%
    Melon 62.22%
    Pear 58.95%
    Citrus 56.57%
    Fresh 55.59%
    Tropical 49.48%
    Cucumber 46.81%

     

    Flavor
    Waxy 60.1%
    Green 59.96%
    Fresh 50.02%
    Rose 49.2%
    Floral 46.64%
    Fruity 45.35%
    Tropical 39.67%
    Sweet 36.25%
    Pear 35.82%
    Melon 34.72%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    3.5

    pKa est.
    8.39 (weak base)

    Molecular weight
    184.27 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately slow

    Boiling point est.
    226°C

    Flash point

    • 101.06 ˚C est.

    Solubility expt.

    • Very slightly soluble
    • Soluble (in ethanol)

  • Synonyms

    • (Z)-3-Nonenyl acetate
    • 13049-88-2
    • cis-3-Nonenyl acetate
    • 3-Nonen-1-ol, 1-acetate, (3Z)-
    • 3-Nonenyl acetate, (3Z)-
    • 3-Nonen-1-ol, acetate, (3Z)-
    • [(Z)-non-3-enyl] acetate
    • FEMA No. 4553
    • 3-Nonen-1-ol, acetate, (Z)-
    • G174WAD1GS
    • (3Z)-3-Nonenyl acetate
    • UNII-G174WAD1GS
    • 3-NONENYL ACETATE, CIS-
    • DTXSID80893230
    • PEAR ACETATE
    • (Z)-non-3-enyl acetate
    • cis-3-Nonen-1-ol, acetate
    • (Z)-Non-3-en-1-yl acetate
    • DTXCID401323164
    • Acetic acid, non-3-enyl ester, cis-
    • (3Z)-NON-3-EN-1-YL ACETATE
    • Q27278555

  • Applications

    cis-3-Nonenyl acetate (CAS 13049-88-2) is an acetate ester with a distinctive “cucumber-green leaf” scent that is isolated or synthesized for use as a flavour ingredient in beverages, confectionery, yogurt products and seafood analogues; it refines fresh green top notes in fine fragrances, soaps, detergents and personal-care cosmetics, and serves in scented candles and diffuser oils; the molecule is also applied in agriculture as a pollinator attractant, in biochemical research on pheromone signaling, and in biomedical analytics as a GC-MS reference odorant, all while complying with IFRA/FEMA regulations and requiring storage in sealed, light- and heat-protected containers to preserve its olfactory integrity.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2258.29
    methanol 2382.03
    isopropanol 1579.81
    water 0.11
    ethyl acetate 1203.8
    n-propanol 1532.03
    acetone 2022.87
    n-butanol 1302.11
    acetonitrile 1070.75
    DMF 1506.19
    toluene 558.76
    isobutanol 988.42
    1,4-dioxane 1975.25
    methyl acetate 872.99
    THF 2774.2
    2-butanone 1336.81
    n-pentanol 1049.99
    sec-butanol 1228.31
    n-hexane 402.17
    ethylene glycol 218.01
    NMP 1111.03
    cyclohexane 362.54
    DMSO 2523.58
    n-butyl acetate 885.77
    n-octanol 285.51
    chloroform 2311.95
    n-propyl acetate 754.37
    acetic acid 996.92
    dichloromethane 2066.91
    cyclohexanone 1692.27
    propylene glycol 476.43
    isopropyl acetate 759.96
    DMAc 1163.94
    2-ethoxyethanol 1243.59
    isopentanol 1016.44
    n-heptane 104.45
    ethyl formate 462.44
    1,2-dichloroethane 1461.35
    n-hexanol 885.68
    2-methoxyethanol 1739.13
    isobutyl acetate 475.39
    tetrachloromethane 324.55
    n-pentyl acetate 433.96
    transcutol 3840.07
    n-heptanol 248.69
    ethylbenzene 284.92
    MIBK 657.49
    2-propoxyethanol 1229.59
    tert-butanol 1819.12
    MTBE 1617.53
    2-butoxyethanol 500.51
    propionic acid 728.12
    o-xylene 293.82
    formic acid 236.55
    diethyl ether 1938.22
    m-xylene 352.83
    p-xylene 317.67
    chlorobenzene 581.73
    dimethyl carbonate 198.5
    n-octane 31.97
    formamide 327.55
    cyclopentanone 1526.35
    2-pentanone 1246.47
    anisole 564.57
    cyclopentyl methyl ether 1469.74
    gamma-butyrolactone 1241.12
    1-methoxy-2-propanol 1310.0
    pyridine 1412.09
    3-pentanone 769.66
    furfural 893.84
    n-dodecane 22.4
    diethylene glycol 706.25
    diisopropyl ether 405.2
    tert-amyl alcohol 1354.14
    acetylacetone 1006.4
    n-hexadecane 26.32
    acetophenone 459.22
    methyl propionate 755.69
    isopentyl acetate 763.7
    trichloroethylene 2061.97
    n-nonanol 248.4
    cyclohexanol 1163.27
    benzyl alcohol 482.78
    2-ethylhexanol 489.45
    isooctanol 215.8
    dipropyl ether 653.12
    1,2-dichlorobenzene 478.24
    ethyl lactate 270.55
    propylene carbonate 608.4
    n-methylformamide 637.86
    2-pentanol 862.35
    n-pentane 212.09
    1-propoxy-2-propanol 905.32
    1-methoxy-2-propyl acetate 736.65
    2-(2-methoxypropoxy) propanol 601.04
    mesitylene 226.16
    ε-caprolactone 1184.53
    p-cymene 149.07
    epichlorohydrin 1751.17
    1,1,1-trichloroethane 1214.7
    2-aminoethanol 654.95
    morpholine-4-carbaldehyde 1120.71
    sulfolane 1540.91
    2,2,4-trimethylpentane 89.59
    2-methyltetrahydrofuran 2275.75
    n-hexyl acetate 623.02
    isooctane 67.56
    2-(2-butoxyethoxy)ethanol 843.61
    sec-butyl acetate 522.72
    tert-butyl acetate 829.43
    decalin 153.56
    glycerin 477.8
    diglyme 1357.11
    acrylic acid 473.84
    isopropyl myristate 216.8
    n-butyric acid 1151.74
    acetyl acetate 543.05
    di(2-ethylhexyl) phthalate 208.15
    ethyl propionate 600.36
    nitromethane 1256.74
    1,2-diethoxyethane 1239.11
    benzonitrile 538.43
    trioctyl phosphate 139.71
    1-bromopropane 1243.64
    gamma-valerolactone 1574.64
    n-decanol 172.8
    triethyl phosphate 220.35
    4-methyl-2-pentanol 419.68
    propionitrile 832.15
    vinylene carbonate 479.85
    1,1,2-trichlorotrifluoroethane 1140.6
    DMS 424.67
    cumene 183.17
    2-octanol 186.35
    2-hexanone 893.52
    octyl acetate 265.98
    limonene 293.49
    1,2-dimethoxyethane 1665.43
    ethyl orthosilicate 239.22
    tributyl phosphate 208.18
    diacetone alcohol 804.64
    N,N-dimethylaniline 372.87
    acrylonitrile 779.51
    aniline 725.12
    1,3-propanediol 863.84
    bromobenzene 661.79
    dibromomethane 1602.43
    1,1,2,2-tetrachloroethane 1953.45
    2-methyl-cyclohexyl acetate 439.14
    tetrabutyl urea 262.35
    diisobutyl methanol 239.53
    2-phenylethanol 457.97
    styrene 403.18
    dioctyl adipate 349.94
    dimethyl sulfate 340.7
    ethyl butyrate 545.85
    methyl lactate 328.94
    butyl lactate 336.54
    diethyl carbonate 310.68
    propanediol butyl ether 557.18
    triethyl orthoformate 370.1
    p-tert-butyltoluene 151.28
    methyl 4-tert-butylbenzoate 361.97
    morpholine 2858.7
    tert-butylamine 1155.48
    n-dodecanol 127.72
    dimethoxymethane 1041.27
    ethylene carbonate 442.07
    cyrene 434.88
    2-ethoxyethyl acetate 609.98
    2-ethylhexyl acetate 585.0
    1,2,4-trichlorobenzene 566.68
    4-methylpyridine 1283.42
    dibutyl ether 570.65
    2,6-dimethyl-4-heptanol 239.53
    DEF 1093.72
    dimethyl isosorbide 827.31
    tetrachloroethylene 1170.64
    eugenol 365.92
    triacetin 553.62
    span 80 536.77
    1,4-butanediol 356.16
    1,1-dichloroethane 1490.69
    2-methyl-1-pentanol 863.25
    methyl formate 341.25
    2-methyl-1-butanol 980.54
    n-decane 42.69
    butyronitrile 961.78
    3,7-dimethyl-1-octanol 324.85
    1-chlorooctane 212.13
    1-chlorotetradecane 73.08
    n-nonane 45.79
    undecane 29.6
    tert-butylcyclohexane 133.86
    cyclooctane 94.44
    cyclopentanol 1046.85
    tetrahydropyran 2631.77
    tert-amyl methyl ether 1021.66
    2,5,8-trioxanonane 949.19
    1-hexene 1110.24
    2-isopropoxyethanol 841.87
    2,2,2-trifluoroethanol 182.84
    methyl butyrate 780.7

    Scent© AI

1 4

IFRA standard 51

Recommendation
Restriction
Maximum acceptable concentrations in the finished product (%)
Category 1
Products applied to the lips
 0.077 % Category 7A
Rinse-off products applied to the hair with some hand contact
 0.88 %
Category 2
Products applied to the axillae
 0.023 % Category 7B
Leave-on products applied to the hair with some hand contact
 0.88 %
Category 3
Products applied to the face/body using fingertips
 0.46 % Category 8
Products with significant anogenital exposure
 0.037 %
Category 4
Products related to fine fragrance
 0.43 % Category 9
Products with body and hand exposure, primarily rinse off
 0.84 %
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
 0.11 % Category 10A
Household care products with mostly hand contact
 3 %
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
 0.11 % Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
 3 %
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
 0.11 % Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
 0.037 %
Category 5D
Baby Creams, baby Oils and baby talc
 0.037 % Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
 0.037 %
Category 6
Products with oral and lip exposure
 0.25 % Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
 No restriction