Athylglykolsaurementhylester

  • Identifiers

    Molecular formula
    C14H26O3

    SMILES
    CCC(C(=O)OC1CC(CCC1C(C)C)C)O

  • Odor profile

    Fragrance
    Mint 67.38%
    Cooling 53.63%
    Odorless 46.48%
    Fruity 39.26%
    Fresh 34.88%
    Herbal 34.07%
    Sweet 22.9%
    Camphoreous 21.79%
    Woody 21.44%
    Warm 19.88%

     

    Flavor
    Fruity 46.9%
    Sweet 31.05%
    Odorless 27.72%
    Herbal 25.89%
    Mild 22.33%
    Tropical 22.17%
    Sweet-like 20.82%
    Fruit 20.68%
    Mentholic 20.28%
    Minty 19.95%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    3.9

    pKa est.
    7.42 (neutral)

    Molecular weight
    242.35 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very slow

    Boiling point est.
    283°C

    Flash point

    • 122.18 ˚C est.

  • Synonyms

    • Athylglykolsaurementhylester
    • SCHEMBL5837344
  • Applications

    Athylglykolsaurementhylester (CAS number: ) is used as a solvent and a chemical intermediate in industrial manufacturing; it is also employed as a plasticizer for polymers, a stabilizer in coatings and inks, and as a surfactant or co-solvent in cleaning formulations and other industrial applications.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2435.48
    methanol 2815.3
    isopropanol 1941.13
    water 1.36
    ethyl acetate 1809.82
    n-propanol 1846.29
    acetone 2071.61
    n-butanol 1555.02
    acetonitrile 1026.18
    DMF 1362.96
    toluene 525.1
    isobutanol 1403.68
    1,4-dioxane 2232.42
    methyl acetate 1163.04
    THF 2713.44
    2-butanone 1395.92
    n-pentanol 769.43
    sec-butanol 1534.05
    n-hexane 108.4
    ethylene glycol 199.31
    NMP 1470.1
    cyclohexane 347.21
    DMSO 1646.46
    n-butyl acetate 1522.24
    n-octanol 412.78
    chloroform 2707.9
    n-propyl acetate 877.31
    acetic acid 1921.88
    dichloromethane 2303.83
    cyclohexanone 2523.92
    propylene glycol 396.92
    isopropyl acetate 1168.16
    DMAc 950.85
    2-ethoxyethanol 948.76
    isopentanol 1284.63
    n-heptane 59.25
    ethyl formate 980.94
    1,2-dichloroethane 1793.25
    n-hexanol 1172.99
    2-methoxyethanol 1812.31
    isobutyl acetate 547.98
    tetrachloromethane 460.43
    n-pentyl acetate 820.44
    transcutol 3446.71
    n-heptanol 484.13
    ethylbenzene 309.51
    MIBK 789.58
    2-propoxyethanol 1380.45
    tert-butanol 2076.61
    MTBE 1596.08
    2-butoxyethanol 836.22
    propionic acid 1167.07
    o-xylene 383.48
    formic acid 565.52
    diethyl ether 1397.48
    m-xylene 383.57
    p-xylene 459.49
    chlorobenzene 955.2
    dimethyl carbonate 292.26
    n-octane 32.22
    formamide 852.69
    cyclopentanone 2153.38
    2-pentanone 1291.95
    anisole 546.24
    cyclopentyl methyl ether 1271.06
    gamma-butyrolactone 2322.7
    1-methoxy-2-propanol 1339.84
    pyridine 1597.57
    3-pentanone 763.92
    furfural 1615.77
    n-dodecane 23.53
    diethylene glycol 811.97
    diisopropyl ether 460.94
    tert-amyl alcohol 1565.52
    acetylacetone 1298.95
    n-hexadecane 28.15
    acetophenone 569.48
    methyl propionate 890.04
    isopentyl acetate 1339.83
    trichloroethylene 3169.27
    n-nonanol 349.57
    cyclohexanol 1550.45
    benzyl alcohol 531.0
    2-ethylhexanol 598.22
    isooctanol 416.19
    dipropyl ether 515.7
    1,2-dichlorobenzene 812.29
    ethyl lactate 308.89
    propylene carbonate 1325.6
    n-methylformamide 947.41
    2-pentanol 1108.96
    n-pentane 116.67
    1-propoxy-2-propanol 1086.3
    1-methoxy-2-propyl acetate 997.81
    2-(2-methoxypropoxy) propanol 548.64
    mesitylene 281.76
    ε-caprolactone 2057.85
    p-cymene 231.68
    epichlorohydrin 2364.26
    1,1,1-trichloroethane 1600.63
    2-aminoethanol 603.99
    morpholine-4-carbaldehyde 1389.76
    sulfolane 2150.59
    2,2,4-trimethylpentane 87.45
    2-methyltetrahydrofuran 2180.3
    n-hexyl acetate 999.5
    isooctane 68.53
    2-(2-butoxyethoxy)ethanol 951.08
    sec-butyl acetate 649.54
    tert-butyl acetate 983.29
    decalin 123.28
    glycerin 462.86
    diglyme 1565.93
    acrylic acid 864.49
    isopropyl myristate 278.75
    n-butyric acid 2236.76
    acetyl acetate 947.99
    di(2-ethylhexyl) phthalate 280.91
    ethyl propionate 632.77
    nitromethane 2136.85
    1,2-diethoxyethane 1121.36
    benzonitrile 735.42
    trioctyl phosphate 216.54
    1-bromopropane 942.91
    gamma-valerolactone 2653.4
    n-decanol 232.12
    triethyl phosphate 244.17
    4-methyl-2-pentanol 579.13
    propionitrile 835.55
    vinylene carbonate 1067.59
    1,1,2-trichlorotrifluoroethane 1445.09
    DMS 580.13
    cumene 228.61
    2-octanol 357.31
    2-hexanone 729.49
    octyl acetate 378.54
    limonene 406.41
    1,2-dimethoxyethane 1343.77
    ethyl orthosilicate 266.27
    tributyl phosphate 278.8
    diacetone alcohol 976.31
    N,N-dimethylaniline 350.44
    acrylonitrile 850.06
    aniline 768.4
    1,3-propanediol 1184.37
    bromobenzene 954.32
    dibromomethane 1634.45
    1,1,2,2-tetrachloroethane 2632.64
    2-methyl-cyclohexyl acetate 566.99
    tetrabutyl urea 306.52
    diisobutyl methanol 339.32
    2-phenylethanol 657.64
    styrene 380.64
    dioctyl adipate 381.66
    dimethyl sulfate 450.59
    ethyl butyrate 719.49
    methyl lactate 419.88
    butyl lactate 587.11
    diethyl carbonate 396.65
    propanediol butyl ether 751.32
    triethyl orthoformate 456.49
    p-tert-butyltoluene 225.46
    methyl 4-tert-butylbenzoate 532.6
    morpholine 2642.52
    tert-butylamine 1217.36
    n-dodecanol 163.6
    dimethoxymethane 869.61
    ethylene carbonate 1053.95
    cyrene 487.25
    2-ethoxyethyl acetate 978.5
    2-ethylhexyl acetate 957.43
    1,2,4-trichlorobenzene 942.28
    4-methylpyridine 1508.31
    dibutyl ether 489.92
    2,6-dimethyl-4-heptanol 339.32
    DEF 1083.56
    dimethyl isosorbide 929.46
    tetrachloroethylene 1728.41
    eugenol 503.49
    triacetin 626.44
    span 80 580.92
    1,4-butanediol 369.72
    1,1-dichloroethane 1859.04
    2-methyl-1-pentanol 746.27
    methyl formate 699.25
    2-methyl-1-butanol 1143.83
    n-decane 44.13
    butyronitrile 1086.63
    3,7-dimethyl-1-octanol 452.06
    1-chlorooctane 269.16
    1-chlorotetradecane 86.91
    n-nonane 42.79
    undecane 30.55
    tert-butylcyclohexane 95.58
    cyclooctane 86.38
    cyclopentanol 1294.82
    tetrahydropyran 2520.31
    tert-amyl methyl ether 870.91
    2,5,8-trioxanonane 860.28
    1-hexene 387.65
    2-isopropoxyethanol 660.42
    2,2,2-trifluoroethanol 528.89
    methyl butyrate 976.98

    Scent© AI

1 of 4
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