1,2-Diethylcyclohexane

  • Identifiers

    Molecular formula
    C10H20

    SMILES
    CCC1CCCCC1CC

  • Odor profile

    Fragrance
    Citrus 37.15%
    Gassy 35.06%
    Sweet 34.58%
    Fresh 29.6%
    Woody 24.85%
    Dry 24.0%
    Waxy 22.39%
    Lemon 21.57%
    Pine 21.11%
    Clean 19.57%

     

    Flavor
    Alkane 35.43%
    Old paper 20.42%
    Sweet 20.33%
    Terpenic 20.25%
    Terpentine 19.93%
    Alkaline 19.89%
    Beet 19.77%
    Soil 19.76%
    Mentholic 19.58%
    Shrimp 19.46%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    4.8

    pKa est.
    10.24 (weak base)

    Molecular weight
    140.27 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very fast

    Boiling point est.
    172°C

    Flash point

    • 50.02 ˚C est.

  • Synonyms

    • 1,2-Diethylcyclohexane
  • Applications

    1,2-Diethylcyclohexane can be used as a non-polar solvent or diluent in industrial formulations, for example in coatings, inks, and adhesives; it is also used as a solvent for processing plastics and polymers during formulation. As a reagent, intermediate, or building block, it may participate in the synthesis of cyclohexane-ring derivatives and related bulky hydrocarbon compounds. Additionally, it can appear in cleaning and degreasing formulations for industrial equipment as a hydrocarbon solvent. In plastic and polymer processing, it may serve as a base oil or diluent in lubricant formulations or as a processing aid for plastics, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 659.71
    methanol 342.46
    isopropanol 867.61
    water 0.03
    ethyl acetate 2464.55
    n-propanol 950.05
    acetone 2276.4
    n-butanol 1217.63
    acetonitrile 1440.58
    DMF 1381.55
    toluene 2332.07
    isobutanol 937.75
    1,4-dioxane 4074.3
    methyl acetate 1841.6
    THF 7357.3
    2-butanone 2482.25
    n-pentanol 702.03
    sec-butanol 1048.49
    n-hexane 1949.88
    ethylene glycol 37.02
    NMP 2057.14
    cyclohexane 3437.62
    DMSO 1341.3
    n-butyl acetate 6101.64
    n-octanol 894.0
    chloroform 4979.26
    n-propyl acetate 1990.55
    acetic acid 386.85
    dichloromethane 4658.68
    cyclohexanone 4746.38
    propylene glycol 91.72
    isopropyl acetate 1869.71
    DMAc 1017.52
    2-ethoxyethanol 596.97
    isopentanol 1283.76
    n-heptane 2904.04
    ethyl formate 1059.61
    1,2-dichloroethane 3690.16
    n-hexanol 2088.13
    2-methoxyethanol 879.14
    isobutyl acetate 1349.92
    tetrachloromethane 1700.97
    n-pentyl acetate 1910.0
    transcutol 2300.4
    n-heptanol 893.22
    ethylbenzene 984.87
    MIBK 1649.03
    2-propoxyethanol 1856.76
    tert-butanol 1483.47
    MTBE 3297.44
    2-butoxyethanol 982.71
    propionic acid 615.83
    o-xylene 1166.23
    formic acid 35.16
    diethyl ether 4212.92
    m-xylene 1349.18
    p-xylene 1178.99
    chlorobenzene 2398.58
    dimethyl carbonate 409.18
    n-octane 782.98
    formamide 79.83
    cyclopentanone 4445.86
    2-pentanone 2483.16
    anisole 1292.1
    cyclopentyl methyl ether 4330.36
    gamma-butyrolactone 3631.74
    1-methoxy-2-propanol 890.15
    pyridine 3291.27
    3-pentanone 2111.73
    furfural 1999.93
    n-dodecane 360.07
    diethylene glycol 439.75
    diisopropyl ether 1682.69
    tert-amyl alcohol 1342.11
    acetylacetone 1814.04
    n-hexadecane 442.13
    acetophenone 937.35
    methyl propionate 1444.32
    isopentyl acetate 4213.57
    trichloroethylene 4795.88
    n-nonanol 815.64
    cyclohexanol 1893.02
    benzyl alcohol 549.68
    2-ethylhexanol 2273.08
    isooctanol 857.72
    dipropyl ether 5897.99
    1,2-dichlorobenzene 1982.42
    ethyl lactate 376.09
    propylene carbonate 2105.11
    n-methylformamide 490.28
    2-pentanol 1165.73
    n-pentane 1553.84
    1-propoxy-2-propanol 2211.76
    1-methoxy-2-propyl acetate 2277.29
    2-(2-methoxypropoxy) propanol 675.98
    mesitylene 1027.89
    ε-caprolactone 3223.34
    p-cymene 1254.75
    epichlorohydrin 4015.11
    1,1,1-trichloroethane 4535.14
    2-aminoethanol 132.42
    morpholine-4-carbaldehyde 1689.47
    sulfolane 3552.35
    2,2,4-trimethylpentane 579.76
    2-methyltetrahydrofuran 6052.56
    n-hexyl acetate 2103.44
    isooctane 554.92
    2-(2-butoxyethoxy)ethanol 1002.18
    sec-butyl acetate 1348.29
    tert-butyl acetate 2271.82
    decalin 958.26
    glycerin 115.24
    diglyme 2270.67
    acrylic acid 355.62
    isopropyl myristate 1044.3
    n-butyric acid 1498.48
    acetyl acetate 1180.49
    di(2-ethylhexyl) phthalate 447.79
    ethyl propionate 1597.97
    nitromethane 928.61
    1,2-diethoxyethane 3276.47
    benzonitrile 1374.39
    trioctyl phosphate 464.07
    1-bromopropane 4490.99
    gamma-valerolactone 3484.92
    n-decanol 610.12
    triethyl phosphate 870.0
    4-methyl-2-pentanol 742.01
    propionitrile 1971.24
    vinylene carbonate 1511.71
    1,1,2-trichlorotrifluoroethane 1147.26
    DMS 943.84
    cumene 657.99
    2-octanol 756.75
    2-hexanone 2100.1
    octyl acetate 1051.69
    limonene 2570.54
    1,2-dimethoxyethane 2420.19
    ethyl orthosilicate 944.4
    tributyl phosphate 667.13
    diacetone alcohol 1231.07
    N,N-dimethylaniline 776.06
    acrylonitrile 1512.33
    aniline 1377.4
    1,3-propanediol 339.48
    bromobenzene 3090.98
    dibromomethane 4296.69
    1,1,2,2-tetrachloroethane 3945.79
    2-methyl-cyclohexyl acetate 1711.91
    tetrabutyl urea 816.03
    diisobutyl methanol 1469.67
    2-phenylethanol 1014.68
    styrene 1286.05
    dioctyl adipate 935.89
    dimethyl sulfate 538.2
    ethyl butyrate 3517.66
    methyl lactate 324.18
    butyl lactate 823.26
    diethyl carbonate 1629.39
    propanediol butyl ether 493.51
    triethyl orthoformate 2127.38
    p-tert-butyltoluene 1217.95
    methyl 4-tert-butylbenzoate 874.24
    morpholine 3724.43
    tert-butylamine 1458.55
    n-dodecanol 501.76
    dimethoxymethane 1467.27
    ethylene carbonate 1602.5
    cyrene 520.77
    2-ethoxyethyl acetate 1506.57
    2-ethylhexyl acetate 3759.52
    1,2,4-trichlorobenzene 1855.66
    4-methylpyridine 3108.1
    dibutyl ether 3353.08
    2,6-dimethyl-4-heptanol 1469.67
    DEF 2232.99
    dimethyl isosorbide 1739.21
    tetrachloroethylene 2579.45
    eugenol 599.68
    triacetin 936.8
    span 80 746.23
    1,4-butanediol 118.06
    1,1-dichloroethane 3861.25
    2-methyl-1-pentanol 761.37
    methyl formate 442.73
    2-methyl-1-butanol 1156.38
    n-decane 705.46
    butyronitrile 2550.15
    3,7-dimethyl-1-octanol 1169.98
    1-chlorooctane 1571.58
    1-chlorotetradecane 591.41
    n-nonane 835.5
    undecane 477.98
    tert-butylcyclohexane 850.25
    cyclooctane 1386.66
    cyclopentanol 1782.83
    tetrahydropyran 6604.06
    tert-amyl methyl ether 2273.26
    2,5,8-trioxanonane 1189.01
    1-hexene 2999.54
    2-isopropoxyethanol 575.8
    2,2,2-trifluoroethanol 113.24
    methyl butyrate 2141.05

    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