1,5-Dimethyl-1-vinylhex-4-enyl heptanoate

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  • Identifiers

    CAS number
    71617-11-3

    Molecular formula
    C17H30O2

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

  • Odor profile

    Fragrance
    Fruity 80.79%
    Floral 64.34%
    Rose 57.05%
    Sweet 54.31%
    Green 52.72%
    Herbal 49.02%
    Citrus 46.16%
    Waxy 43.94%
    Pear 42.41%
    Tropical 39.5%

     

    Flavor
    Fruity 69.91%
    Green 53.37%
    Sweet 52.62%
    Herbal 46.87%
    Bergamot 44.29%
    Woody 44.11%
    Rose 37.62%
    Tropical 37.28%
    Floral 36.11%
    Lavender 34.72%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    5.8

    pKa est.
    7.91 (neutral)

    Molecular weight
    266.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    297°C

    Flash point

    • 134.08 ˚C est.

  • Synonyms

    • 71617-11-3
    • 1,5-Dimethyl-1-vinylhex-4-enyl heptanoate
    • EINECS 275-703-0
    • Linalyl heptanoate
    • 3,7-DIMETHYLOCTA-1,6-DIEN-3-YL HEPTANOATE
    • DTXSID70992180
    • NS00061252

  • Applications

    1,5-Dimethyl-1-vinylhex-4-enyl heptanoate (CAS 71617-11-3) is primarily used as a fragrance ingredient in perfumery to impart a specific aroma and may serve as an intermediate in fragrance synthesis; in cosmetics and personal care, it is included as a fragrance component in scented products such as creams and lotions; in household and cleaning products, it functions as an odorant to impart and maintain aroma in detergents, air fresheners, and cleaners; in polymer, coating, and packaging applications, it can act as a fragrance-release or scent-enhancement additive, contributing to long-lasting aroma in finished goods, with use governed by local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3865.7
    methanol 2857.73
    isopropanol 3200.35
    water 0.09
    ethyl acetate 4885.9
    n-propanol 3251.01
    acetone 3388.11
    n-butanol 3388.13
    acetonitrile 1590.05
    DMF 3299.07
    toluene 2777.16
    isobutanol 2950.45
    1,4-dioxane 4427.31
    methyl acetate 2493.66
    THF 6698.72
    2-butanone 3832.52
    n-pentanol 2730.99
    sec-butanol 4020.56
    n-hexane 1508.48
    ethylene glycol 104.56
    NMP 3414.76
    cyclohexane 1948.62
    DMSO 2111.73
    n-butyl acetate 3877.85
    n-octanol 1315.55
    chloroform 6442.1
    n-propyl acetate 2566.46
    acetic acid 1381.49
    dichloromethane 5637.44
    cyclohexanone 5826.57
    propylene glycol 381.94
    isopropyl acetate 3812.31
    DMAc 3873.9
    2-ethoxyethanol 1939.82
    isopentanol 3594.02
    n-heptane 567.48
    ethyl formate 1444.35
    1,2-dichloroethane 4047.53
    n-hexanol 3254.81
    2-methoxyethanol 2464.48
    isobutyl acetate 1966.24
    tetrachloromethane 1006.42
    n-pentyl acetate 2484.16
    transcutol 7507.73
    n-heptanol 1197.48
    ethylbenzene 1567.32
    MIBK 2651.62
    2-propoxyethanol 3097.62
    tert-butanol 4100.26
    MTBE 6948.79
    2-butoxyethanol 1625.95
    propionic acid 1344.25
    o-xylene 1588.41
    formic acid 239.45
    diethyl ether 6353.24
    m-xylene 1764.06
    p-xylene 1954.94
    chlorobenzene 2410.86
    dimethyl carbonate 626.07
    n-octane 215.73
    formamide 391.94
    cyclopentanone 3807.21
    2-pentanone 4064.29
    anisole 2119.58
    cyclopentyl methyl ether 4581.99
    gamma-butyrolactone 3217.54
    1-methoxy-2-propanol 2413.5
    pyridine 3574.43
    3-pentanone 2796.01
    furfural 2179.21
    n-dodecane 135.62
    diethylene glycol 1084.48
    diisopropyl ether 2228.25
    tert-amyl alcohol 4589.2
    acetylacetone 2865.19
    n-hexadecane 162.44
    acetophenone 1709.76
    methyl propionate 2623.47
    isopentyl acetate 3882.8
    trichloroethylene 5942.26
    n-nonanol 1158.74
    cyclohexanol 3939.97
    benzyl alcohol 1330.28
    2-ethylhexanol 2113.95
    isooctanol 1085.27
    dipropyl ether 2441.28
    1,2-dichlorobenzene 2030.07
    ethyl lactate 702.67
    propylene carbonate 2148.04
    n-methylformamide 1094.44
    2-pentanol 3341.14
    n-pentane 975.8
    1-propoxy-2-propanol 2522.85
    1-methoxy-2-propyl acetate 2737.42
    2-(2-methoxypropoxy) propanol 1664.89
    mesitylene 1105.22
    ε-caprolactone 4726.17
    p-cymene 819.84
    epichlorohydrin 4597.85
    1,1,1-trichloroethane 4189.5
    2-aminoethanol 541.82
    morpholine-4-carbaldehyde 3173.71
    sulfolane 3183.28
    2,2,4-trimethylpentane 550.74
    2-methyltetrahydrofuran 7169.89
    n-hexyl acetate 3546.17
    isooctane 377.8
    2-(2-butoxyethoxy)ethanol 2334.62
    sec-butyl acetate 2421.26
    tert-butyl acetate 3477.13
    decalin 802.53
    glycerin 368.69
    diglyme 3638.71
    acrylic acid 686.18
    isopropyl myristate 1127.31
    n-butyric acid 3337.64
    acetyl acetate 1952.36
    di(2-ethylhexyl) phthalate 839.81
    ethyl propionate 2419.11
    nitromethane 1863.57
    1,2-diethoxyethane 3969.07
    benzonitrile 1753.12
    trioctyl phosphate 607.33
    1-bromopropane 3940.67
    gamma-valerolactone 4543.1
    n-decanol 775.27
    triethyl phosphate 760.32
    4-methyl-2-pentanol 1859.43
    propionitrile 1881.63
    vinylene carbonate 1604.93
    1,1,2-trichlorotrifluoroethane 2197.38
    DMS 1574.82
    cumene 1018.57
    2-octanol 1105.79
    2-hexanone 2802.16
    octyl acetate 1391.14
    limonene 1712.77
    1,2-dimethoxyethane 3712.86
    ethyl orthosilicate 870.61
    tributyl phosphate 853.51
    diacetone alcohol 2408.15
    N,N-dimethylaniline 1503.25
    acrylonitrile 1364.05
    aniline 1969.77
    1,3-propanediol 1160.14
    bromobenzene 2853.18
    dibromomethane 4384.39
    1,1,2,2-tetrachloroethane 5616.69
    2-methyl-cyclohexyl acetate 1821.38
    tetrabutyl urea 1065.65
    diisobutyl methanol 1027.56
    2-phenylethanol 1601.1
    styrene 1789.05
    dioctyl adipate 1354.62
    dimethyl sulfate 779.74
    ethyl butyrate 2332.59
    methyl lactate 677.16
    butyl lactate 1331.99
    diethyl carbonate 1216.29
    propanediol butyl ether 1308.44
    triethyl orthoformate 1439.16
    p-tert-butyltoluene 751.58
    methyl 4-tert-butylbenzoate 1468.87
    morpholine 6178.73
    tert-butylamine 3113.3
    n-dodecanol 572.81
    dimethoxymethane 2511.27
    ethylene carbonate 1675.61
    cyrene 1080.58
    2-ethoxyethyl acetate 2451.89
    2-ethylhexyl acetate 3112.69
    1,2,4-trichlorobenzene 2358.91
    4-methylpyridine 4780.51
    dibutyl ether 2766.68
    2,6-dimethyl-4-heptanol 1027.56
    DEF 4171.81
    dimethyl isosorbide 2496.2
    tetrachloroethylene 3324.34
    eugenol 1226.32
    triacetin 1901.49
    span 80 1585.76
    1,4-butanediol 463.07
    1,1-dichloroethane 4562.0
    2-methyl-1-pentanol 2999.27
    methyl formate 670.23
    2-methyl-1-butanol 3440.82
    n-decane 277.27
    butyronitrile 2902.88
    3,7-dimethyl-1-octanol 1602.2
    1-chlorooctane 1221.84
    1-chlorotetradecane 420.16
    n-nonane 295.08
    undecane 182.68
    tert-butylcyclohexane 715.49
    cyclooctane 539.22
    cyclopentanol 2608.9
    tetrahydropyran 8906.46
    tert-amyl methyl ether 4740.39
    2,5,8-trioxanonane 2299.53
    1-hexene 3763.17
    2-isopropoxyethanol 1769.91
    2,2,2-trifluoroethanol 281.71
    methyl butyrate 3071.57

    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