(1-Propan-2-ylcyclohexyl) acetate

  • Identifiers

    Molecular formula
    C11H20O2

    SMILES
    CC(C)C1(CCCCC1)OC(=O)C

  • Odor profile

    Fragrance
    Fruity 85.1%
    Sweet 72.1%
    Herbal 63.84%
    Woody 63.16%
    Floral 56.81%
    Mint 53.27%
    Camphoreous 41.25%
    Fresh 39.86%
    Pine 34.86%
    Spicy 33.68%

     

    Flavor
    Sweet 59.23%
    Herbal 57.16%
    Fruity 53.03%
    Woody 42.71%
    Tropical 39.03%
    Fruit 37.47%
    Minty 36.6%
    Mint 35.17%
    Raspberry 34.51%
    Camphor 34.37%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    3.1

    pKa est.
    8.92 (weak base)

    Molecular weight
    184.27 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderate

    Boiling point est.
    220°C

    Flash point

    • 92.08 ˚C est.

  • Synonyms

    • SCHEMBL9609263
  • Applications

    (1-Propan-2-ylcyclohexyl) acetate is primarily used as a fragrance ingredient in perfumery and cosmetics, acting as an odorant with potential fixative properties to help stabilize and extend scents in formulations. It may also be employed as a fragrance additive in household products such as air fresheners and cleaners. In industrial manufacturing, it can serve as an intermediate in the synthesis of aroma chemicals for fragrance applications, and may be considered a processing aid or co-solvent in limited formulations, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 802.17
    methanol 1003.11
    isopropanol 992.55
    water 1.47
    ethyl acetate 791.11
    n-propanol 924.38
    acetone 1025.39
    n-butanol 817.36
    acetonitrile 911.67
    DMF 1482.81
    toluene 892.12
    isobutanol 827.45
    1,4-dioxane 1511.74
    methyl acetate 857.53
    THF 1975.88
    2-butanone 1019.88
    n-pentanol 550.92
    sec-butanol 924.19
    n-hexane 231.34
    ethylene glycol 173.4
    NMP 1401.94
    cyclohexane 442.79
    DMSO 885.94
    n-butyl acetate 851.51
    n-octanol 511.53
    chloroform 3837.08
    n-propyl acetate 514.39
    acetic acid 483.47
    dichloromethane 2884.83
    cyclohexanone 1844.49
    propylene glycol 289.82
    isopropyl acetate 564.57
    DMAc 1248.41
    2-ethoxyethanol 484.81
    isopentanol 712.24
    n-heptane 160.27
    ethyl formate 649.35
    1,2-dichloroethane 1518.56
    n-hexanol 858.75
    2-methoxyethanol 815.37
    isobutyl acetate 409.01
    tetrachloromethane 654.24
    n-pentyl acetate 636.23
    transcutol 925.76
    n-heptanol 441.66
    ethylbenzene 505.03
    MIBK 568.77
    2-propoxyethanol 821.31
    tert-butanol 1102.12
    MTBE 1007.51
    2-butoxyethanol 508.8
    propionic acid 646.5
    o-xylene 623.08
    formic acid 136.18
    diethyl ether 835.42
    m-xylene 625.52
    p-xylene 663.77
    chlorobenzene 1227.73
    dimethyl carbonate 299.89
    n-octane 93.27
    formamide 197.65
    cyclopentanone 1716.92
    2-pentanone 818.48
    anisole 743.38
    cyclopentyl methyl ether 1030.1
    gamma-butyrolactone 1743.49
    1-methoxy-2-propanol 692.38
    pyridine 1419.35
    3-pentanone 696.76
    furfural 1388.68
    n-dodecane 88.82
    diethylene glycol 482.56
    diisopropyl ether 324.69
    tert-amyl alcohol 946.65
    acetylacetone 792.16
    n-hexadecane 102.58
    acetophenone 627.27
    methyl propionate 686.43
    isopentyl acetate 758.02
    trichloroethylene 2691.11
    n-nonanol 418.77
    cyclohexanol 1062.31
    benzyl alcohol 558.08
    2-ethylhexanol 499.83
    isooctanol 359.48
    dipropyl ether 502.79
    1,2-dichlorobenzene 1029.25
    ethyl lactate 291.72
    propylene carbonate 1092.41
    n-methylformamide 664.71
    2-pentanol 628.39
    n-pentane 218.68
    1-propoxy-2-propanol 632.76
    1-methoxy-2-propyl acetate 650.0
    2-(2-methoxypropoxy) propanol 476.77
    mesitylene 443.34
    ε-caprolactone 1492.56
    p-cymene 366.04
    epichlorohydrin 1700.21
    1,1,1-trichloroethane 1743.79
    2-aminoethanol 353.79
    morpholine-4-carbaldehyde 1300.8
    sulfolane 1840.08
    2,2,4-trimethylpentane 130.82
    2-methyltetrahydrofuran 1533.13
    n-hexyl acetate 900.75
    isooctane 99.92
    2-(2-butoxyethoxy)ethanol 561.53
    sec-butyl acetate 404.57
    tert-butyl acetate 601.03
    decalin 195.89
    glycerin 311.69
    diglyme 938.86
    acrylic acid 504.99
    isopropyl myristate 360.93
    n-butyric acid 830.34
    acetyl acetate 519.23
    di(2-ethylhexyl) phthalate 342.75
    ethyl propionate 511.32
    nitromethane 860.2
    1,2-diethoxyethane 579.78
    benzonitrile 992.11
    trioctyl phosphate 269.32
    1-bromopropane 1217.59
    gamma-valerolactone 1873.98
    n-decanol 309.96
    triethyl phosphate 278.62
    4-methyl-2-pentanol 371.38
    propionitrile 1015.81
    vinylene carbonate 1049.33
    1,1,2-trichlorotrifluoroethane 941.32
    DMS 595.74
    cumene 373.63
    2-octanol 403.15
    2-hexanone 622.99
    octyl acetate 468.14
    limonene 521.27
    1,2-dimethoxyethane 1012.89
    ethyl orthosilicate 256.14
    tributyl phosphate 299.07
    diacetone alcohol 582.97
    N,N-dimethylaniline 497.87
    acrylonitrile 1074.56
    aniline 783.14
    1,3-propanediol 493.2
    bromobenzene 1435.66
    dibromomethane 2104.57
    1,1,2,2-tetrachloroethane 2310.55
    2-methyl-cyclohexyl acetate 488.2
    tetrabutyl urea 385.16
    diisobutyl methanol 284.08
    2-phenylethanol 610.25
    styrene 600.08
    dioctyl adipate 448.44
    dimethyl sulfate 482.04
    ethyl butyrate 533.53
    methyl lactate 344.48
    butyl lactate 438.86
    diethyl carbonate 368.37
    propanediol butyl ether 475.48
    triethyl orthoformate 359.41
    p-tert-butyltoluene 359.87
    methyl 4-tert-butylbenzoate 602.69
    morpholine 1503.76
    tert-butylamine 809.34
    n-dodecanol 242.8
    dimethoxymethane 794.56
    ethylene carbonate 881.4
    cyrene 443.8
    2-ethoxyethyl acetate 609.06
    2-ethylhexyl acetate 622.33
    1,2,4-trichlorobenzene 1105.61
    4-methylpyridine 1590.31
    dibutyl ether 520.99
    2,6-dimethyl-4-heptanol 284.08
    DEF 889.7
    dimethyl isosorbide 823.29
    tetrachloroethylene 1445.67
    eugenol 510.68
    triacetin 601.26
    span 80 509.42
    1,4-butanediol 242.38
    1,1-dichloroethane 1871.05
    2-methyl-1-pentanol 512.86
    methyl formate 577.37
    2-methyl-1-butanol 730.0
    n-decane 141.18
    butyronitrile 1026.36
    3,7-dimethyl-1-octanol 455.96
    1-chlorooctane 453.6
    1-chlorotetradecane 200.13
    n-nonane 145.47
    undecane 108.61
    tert-butylcyclohexane 181.86
    cyclooctane 153.19
    cyclopentanol 1149.31
    tetrahydropyran 1655.43
    tert-amyl methyl ether 740.76
    2,5,8-trioxanonane 681.52
    1-hexene 571.0
    2-isopropoxyethanol 393.86
    2,2,2-trifluoroethanol 202.68
    methyl butyrate 694.68

    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