1,5,9,13-Tetramethyl-1-vinyltetradecyl acetate

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  • Identifiers

    CAS number
    58425-36-8

    Molecular formula
    C22H42O2

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

    Safety labels

  • Odor profile

    Fragrance
    Floral 84.75%
    Woody 60.87%
    Sweet 58.39%
    Green 57.8%
    Waxy 55.11%
    Fresh 54.2%
    Rose 48.77%
    Balsamic 44.48%
    Fruity 42.28%
    Citrus 41.73%

     

    Flavor
    Woody 47.42%
    Floral 33.4%
    Waxy 29.21%
    Citrus 28.45%
    Oily 28.18%
    Mild 25.67%
    Herbal 25.46%
    Delicate 23.1%
    Wood 22.91%
    Lily 22.87%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    8.4

    pKa est.
    7.4 (neutral)

    Molecular weight
    338.6 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    343°C

    Flash point

    • 157.5 ˚C est.

  • Synonyms

    • 58425-36-8
    • 3,7,11,15-tetramethylhexadec-1-en-3-yl acetate
    • 1,5,9,13-Tetramethyl-1-vinyltetradecyl acetate
    • Isophytol Acetate
    • Isophytol, acetate
    • EINECS 261-243-8
    • Vitamin K1 Impurity 186
    • orb3024906
    • DTXSID00973967
    • DB-259242
    • NS00053088
    • 58425-36-8

  • Applications

    1,5,9,13-Tetramethyl-1-vinyltetradecyl acetate (CAS 58425-36-8) is primarily used as an intermediate in the synthesis of specialty polymers and high-performance coatings. In polymer and coating formulations it can act as a reactive diluent or crosslinkable monomer due to its vinyl group, enabling viscosity control and improved cure characteristics in UV- or electron-beam-curable systems. It also serves as a hydrophobic modifier that can influence toughness and flexibility in polymer blends and adhesive formulations. In industrial manufacturing it may function as a processing aid or precursor for further functionalization, with its long aliphatic chain affecting compatibility with hydrophobic resins.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2016.74
    methanol 1029.63
    isopropanol 2072.57
    water 0.04
    ethyl acetate 3379.88
    n-propanol 2107.4
    acetone 2003.75
    n-butanol 2156.08
    acetonitrile 562.19
    DMF 1510.63
    toluene 1485.72
    isobutanol 1871.01
    1,4-dioxane 3409.43
    methyl acetate 1431.28
    THF 6654.11
    2-butanone 2633.36
    n-pentanol 1752.81
    sec-butanol 2437.79
    n-hexane 1014.54
    ethylene glycol 23.5
    NMP 1971.36
    cyclohexane 1697.47
    DMSO 994.21
    n-butyl acetate 3024.6
    n-octanol 947.63
    chloroform 3694.6
    n-propyl acetate 2513.56
    acetic acid 549.27
    dichloromethane 3262.21
    cyclohexanone 4644.38
    propylene glycol 142.61
    isopropyl acetate 3108.01
    DMAc 2159.94
    2-ethoxyethanol 1467.79
    isopentanol 2338.63
    n-heptane 596.68
    ethyl formate 905.04
    1,2-dichloroethane 2292.74
    n-hexanol 1856.78
    2-methoxyethanol 1554.73
    isobutyl acetate 1909.3
    tetrachloromethane 795.31
    n-pentyl acetate 2512.7
    transcutol 5285.81
    n-heptanol 926.43
    ethylbenzene 1020.68
    MIBK 2312.77
    2-propoxyethanol 2090.86
    tert-butanol 2662.15
    MTBE 5537.14
    2-butoxyethanol 1379.83
    propionic acid 662.86
    o-xylene 993.51
    formic acid 68.17
    diethyl ether 4623.88
    m-xylene 1049.89
    p-xylene 1284.57
    chlorobenzene 1400.74
    dimethyl carbonate 313.03
    n-octane 211.79
    formamide 127.47
    cyclopentanone 3104.4
    2-pentanone 2991.22
    anisole 1430.31
    cyclopentyl methyl ether 4263.02
    gamma-butyrolactone 2371.49
    1-methoxy-2-propanol 1836.42
    pyridine 2015.37
    3-pentanone 1903.76
    furfural 1348.85
    n-dodecane 104.99
    diethylene glycol 497.14
    diisopropyl ether 1878.61
    tert-amyl alcohol 3019.01
    acetylacetone 2110.76
    n-hexadecane 129.8
    acetophenone 1189.24
    methyl propionate 1638.9
    isopentyl acetate 3154.08
    trichloroethylene 3105.81
    n-nonanol 871.74
    cyclohexanol 2744.74
    benzyl alcohol 794.42
    2-ethylhexanol 1529.41
    isooctanol 963.07
    dipropyl ether 2629.36
    1,2-dichlorobenzene 1214.79
    ethyl lactate 533.12
    propylene carbonate 1544.93
    n-methylformamide 481.65
    2-pentanol 2029.86
    n-pentane 662.77
    1-propoxy-2-propanol 2161.6
    1-methoxy-2-propyl acetate 2419.98
    2-(2-methoxypropoxy) propanol 1209.62
    mesitylene 767.99
    ε-caprolactone 3874.77
    p-cymene 691.85
    epichlorohydrin 3199.2
    1,1,1-trichloroethane 2937.83
    2-aminoethanol 205.02
    morpholine-4-carbaldehyde 2100.83
    sulfolane 2225.31
    2,2,4-trimethylpentane 447.49
    2-methyltetrahydrofuran 6769.47
    n-hexyl acetate 2948.12
    isooctane 327.54
    2-(2-butoxyethoxy)ethanol 1731.65
    sec-butyl acetate 2387.07
    tert-butyl acetate 3431.36
    decalin 625.44
    glycerin 135.34
    diglyme 3255.29
    acrylic acid 247.2
    isopropyl myristate 976.77
    n-butyric acid 2191.12
    acetyl acetate 1271.18
    di(2-ethylhexyl) phthalate 630.65
    ethyl propionate 2068.26
    nitromethane 861.22
    1,2-diethoxyethane 3404.64
    benzonitrile 956.66
    trioctyl phosphate 499.31
    1-bromopropane 2721.92
    gamma-valerolactone 3906.38
    n-decanol 576.36
    triethyl phosphate 716.19
    4-methyl-2-pentanol 1385.09
    propionitrile 897.42
    vinylene carbonate 1007.51
    1,1,2-trichlorotrifluoroethane 1204.71
    DMS 994.19
    cumene 711.09
    2-octanol 943.61
    2-hexanone 2465.31
    octyl acetate 1146.83
    limonene 1413.21
    1,2-dimethoxyethane 3254.25
    ethyl orthosilicate 857.29
    tributyl phosphate 630.76
    diacetone alcohol 2077.71
    N,N-dimethylaniline 1010.79
    acrylonitrile 540.72
    aniline 1075.22
    1,3-propanediol 587.69
    bromobenzene 1603.4
    dibromomethane 2641.14
    1,1,2,2-tetrachloroethane 3174.36
    2-methyl-cyclohexyl acetate 1734.62
    tetrabutyl urea 862.78
    diisobutyl methanol 929.51
    2-phenylethanol 1034.67
    styrene 1070.49
    dioctyl adipate 1160.17
    dimethyl sulfate 431.0
    ethyl butyrate 2286.89
    methyl lactate 402.41
    butyl lactate 1222.33
    diethyl carbonate 1009.49
    propanediol butyl ether 967.15
    triethyl orthoformate 1648.27
    p-tert-butyltoluene 664.87
    methyl 4-tert-butylbenzoate 1251.64
    morpholine 4919.72
    tert-butylamine 2163.13
    n-dodecanol 406.57
    dimethoxymethane 1696.88
    ethylene carbonate 1167.3
    cyrene 840.87
    2-ethoxyethyl acetate 2250.61
    2-ethylhexyl acetate 2596.66
    1,2,4-trichlorobenzene 1402.63
    4-methylpyridine 2602.1
    dibutyl ether 2511.49
    2,6-dimethyl-4-heptanol 929.51
    DEF 2620.89
    dimethyl isosorbide 2108.65
    tetrachloroethylene 1837.22
    eugenol 877.56
    triacetin 1688.38
    span 80 1203.13
    1,4-butanediol 214.11
    1,1-dichloroethane 2783.16
    2-methyl-1-pentanol 1902.23
    methyl formate 288.85
    2-methyl-1-butanol 2070.62
    n-decane 256.34
    butyronitrile 1698.05
    3,7-dimethyl-1-octanol 1219.04
    1-chlorooctane 1017.74
    1-chlorotetradecane 308.01
    n-nonane 272.56
    undecane 152.0
    tert-butylcyclohexane 572.81
    cyclooctane 475.24
    cyclopentanol 1928.9
    tetrahydropyran 7530.56
    tert-amyl methyl ether 3640.05
    2,5,8-trioxanonane 1815.53
    1-hexene 2379.91
    2-isopropoxyethanol 1466.43
    2,2,2-trifluoroethanol 127.44
    methyl butyrate 2570.15

    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