Methyl tetradec-8-enoate

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  • Identifiers

    CAS number
    61012-45-1

    Molecular formula
    C15H28O2

    SMILES
    CCCCCC=CCCCCCCC(=O)OC

    Safety labels

  • Odor profile

    Fragrance
    Fatty 80.64%
    Waxy 66.3%
    Oily 64.86%
    Fruity 58.77%
    Sweet 35.89%
    Floral 35.17%
    Dairy 34.53%
    Winey 33.17%
    Creamy 32.74%
    Cognac 31.37%

     

    Flavor
    Waxy 43.78%
    Fatty 30.8%
    Oily 29.89%
    Faint 25.49%
    Soapy 22.47%
    Fruity 22.38%
    Slightly waxy 21.78%
    Delicate 20.99%
    Creamy 20.62%
    Beer 20.48%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    5.4

    pKa est.
    7.64 (neutral)

    Molecular weight
    240.38 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    291°C

    Flash point

    • 130.4 ˚C est.

  • Synonyms

    • METHYL TETRADEC-8-ENOATE
    • 61012-45-1
    • DTXSID70821300
    • 61012-45-1

  • Applications

    Methyl tetradec-8-enoate (CAS 61012-45-1) is a long-chain unsaturated methyl ester used as a specialty monomer and synthesis intermediate. In practice, it can serve as a reactive diluent or plasticizer component in coatings, inks, and polymer formulations; as a building block for specialty polyesters and copolymers via radical or condensation polymerization; as a fragrance ingredient or odor-active intermediate in perfumery; as a processing solvent or aid in industrial manufacturing; and potentially as a lubricant additive or component in lubricant formulations where long-chain esters are valued, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1424.89
    methanol 1103.63
    isopropanol 1534.92
    water 0.01
    ethyl acetate 2556.08
    n-propanol 1344.81
    acetone 2844.84
    n-butanol 1316.84
    acetonitrile 1157.36
    DMF 1649.4
    toluene 942.81
    isobutanol 1067.21
    1,4-dioxane 2809.54
    methyl acetate 1421.4
    THF 4014.8
    2-butanone 2378.18
    n-pentanol 1032.36
    sec-butanol 1512.44
    n-hexane 489.97
    ethylene glycol 47.11
    NMP 1412.95
    cyclohexane 1044.12
    DMSO 2446.26
    n-butyl acetate 1726.31
    n-octanol 360.41
    chloroform 3626.02
    n-propyl acetate 1906.56
    acetic acid 673.17
    dichloromethane 3881.22
    cyclohexanone 3450.25
    propylene glycol 172.79
    isopropyl acetate 1708.45
    DMAc 1500.24
    2-ethoxyethanol 1228.64
    isopentanol 1327.23
    n-heptane 197.04
    ethyl formate 780.44
    1,2-dichloroethane 2988.77
    n-hexanol 831.78
    2-methoxyethanol 1550.94
    isobutyl acetate 1019.27
    tetrachloromethane 658.27
    n-pentyl acetate 1132.08
    transcutol 4329.77
    n-heptanol 355.7
    ethylbenzene 525.51
    MIBK 1382.78
    2-propoxyethanol 1204.45
    tert-butanol 2132.09
    MTBE 2983.68
    2-butoxyethanol 735.94
    propionic acid 620.35
    o-xylene 538.5
    formic acid 87.36
    diethyl ether 3447.12
    m-xylene 598.1
    p-xylene 630.47
    chlorobenzene 1067.44
    dimethyl carbonate 276.62
    n-octane 65.54
    formamide 189.82
    cyclopentanone 2710.79
    2-pentanone 2508.15
    anisole 890.41
    cyclopentyl methyl ether 2484.09
    gamma-butyrolactone 2032.48
    1-methoxy-2-propanol 1430.09
    pyridine 2194.88
    3-pentanone 1503.7
    furfural 1403.22
    n-dodecane 34.67
    diethylene glycol 444.78
    diisopropyl ether 820.88
    tert-amyl alcohol 1772.17
    acetylacetone 1816.15
    n-hexadecane 42.62
    acetophenone 809.65
    methyl propionate 1282.77
    isopentyl acetate 1484.08
    trichloroethylene 4027.53
    n-nonanol 327.76
    cyclohexanol 1651.69
    benzyl alcohol 625.56
    2-ethylhexanol 644.34
    isooctanol 353.91
    dipropyl ether 1328.29
    1,2-dichlorobenzene 981.67
    ethyl lactate 406.43
    propylene carbonate 1039.96
    n-methylformamide 589.92
    2-pentanol 1216.72
    n-pentane 306.61
    1-propoxy-2-propanol 1113.51
    1-methoxy-2-propyl acetate 1262.87
    2-(2-methoxypropoxy) propanol 661.09
    mesitylene 394.64
    ε-caprolactone 2350.3
    p-cymene 274.39
    epichlorohydrin 2977.38
    1,1,1-trichloroethane 2708.01
    2-aminoethanol 241.14
    morpholine-4-carbaldehyde 1508.12
    sulfolane 2232.27
    2,2,4-trimethylpentane 132.97
    2-methyltetrahydrofuran 3886.58
    n-hexyl acetate 1190.77
    isooctane 103.22
    2-(2-butoxyethoxy)ethanol 1008.83
    sec-butyl acetate 1309.16
    tert-butyl acetate 1725.38
    decalin 260.22
    glycerin 195.15
    diglyme 2045.86
    acrylic acid 329.43
    isopropyl myristate 384.44
    n-butyric acid 1593.54
    acetyl acetate 966.68
    di(2-ethylhexyl) phthalate 280.11
    ethyl propionate 1498.63
    nitromethane 1400.86
    1,2-diethoxyethane 2080.05
    benzonitrile 855.9
    trioctyl phosphate 206.75
    1-bromopropane 2426.6
    gamma-valerolactone 2923.02
    n-decanol 213.94
    triethyl phosphate 390.05
    4-methyl-2-pentanol 597.53
    propionitrile 1157.26
    vinylene carbonate 808.82
    1,1,2-trichlorotrifluoroethane 1429.91
    DMS 629.84
    cumene 317.99
    2-octanol 314.31
    2-hexanone 1757.35
    octyl acetate 452.37
    limonene 550.46
    1,2-dimethoxyethane 2587.67
    ethyl orthosilicate 415.95
    tributyl phosphate 299.88
    diacetone alcohol 1307.01
    N,N-dimethylaniline 563.78
    acrylonitrile 913.92
    aniline 883.05
    1,3-propanediol 532.67
    bromobenzene 1287.56
    dibromomethane 2949.67
    1,1,2,2-tetrachloroethane 3612.21
    2-methyl-cyclohexyl acetate 789.22
    tetrabutyl urea 393.46
    diisobutyl methanol 387.84
    2-phenylethanol 559.54
    styrene 712.1
    dioctyl adipate 563.65
    dimethyl sulfate 443.11
    ethyl butyrate 1271.54
    methyl lactate 332.41
    butyl lactate 609.34
    diethyl carbonate 636.22
    propanediol butyl ether 568.28
    triethyl orthoformate 760.1
    p-tert-butyltoluene 259.49
    methyl 4-tert-butylbenzoate 610.09
    morpholine 4009.56
    tert-butylamine 1366.27
    n-dodecanol 155.42
    dimethoxymethane 1366.36
    ethylene carbonate 811.77
    cyrene 530.52
    2-ethoxyethyl acetate 1254.17
    2-ethylhexyl acetate 1136.7
    1,2,4-trichlorobenzene 1065.13
    4-methylpyridine 2035.12
    dibutyl ether 1151.85
    2,6-dimethyl-4-heptanol 387.84
    DEF 2108.16
    dimethyl isosorbide 1164.97
    tetrachloroethylene 2208.06
    eugenol 533.05
    triacetin 892.65
    span 80 656.53
    1,4-butanediol 204.96
    1,1-dichloroethane 3034.68
    2-methyl-1-pentanol 975.19
    methyl formate 342.5
    2-methyl-1-butanol 1209.25
    n-decane 76.85
    butyronitrile 1639.77
    3,7-dimethyl-1-octanol 432.82
    1-chlorooctane 402.67
    1-chlorotetradecane 117.08
    n-nonane 84.15
    undecane 47.58
    tert-butylcyclohexane 196.39
    cyclooctane 219.07
    cyclopentanol 1285.03
    tetrahydropyran 5031.88
    tert-amyl methyl ether 1821.38
    2,5,8-trioxanonane 1180.76
    1-hexene 1446.11
    2-isopropoxyethanol 1018.33
    2,2,2-trifluoroethanol 148.37
    methyl butyrate 2012.73

    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