Cyclohexanemethanol, alpha,4-dimethyl-, acetate, trans-

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  • Identifiers

    CAS number
    63573-88-6

    Molecular formula
    C11H20O2

    SMILES
    CC1CCC(CC1)C(C)OC(=O)C

  • Odor profile

    Fragrance
    Fruity 85.26%
    Floral 72.37%
    Herbal 53.27%
    Woody 50.87%
    Sweet 46.89%
    Fresh 45.96%
    Green 39.8%
    Rose 38.76%
    Mint 33.69%
    Berry 30.05%

     

    Flavor
    Fruity 66.05%
    Herbal 59.42%
    Sweet 55.9%
    Fruit 43.69%
    Tropical 42.33%
    Green 37.26%
    Herb 36.42%
    Mint 36.38%
    Rose 36.29%
    Minty 33.91%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    3.2

    pKa est.
    8.56 (weak base)

    Molecular weight
    184.27 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderate

    Boiling point est.
    217°C

    Flash point

    • 89.19 ˚C est.

  • Synonyms

    • 1-(4-methylcyclohexyl)ethyl acetate
    • 63573-88-6
    • 103983-14-8
    • 63573-89-7
    • Cyclohexanemethanol, alpha,4-dimethyl-, acetate, trans-
    • EINECS 264-328-8
    • EINECS 264-329-3
    • ACETIC ACID 1-(4-METHYLCYCLOHEXYL)ETHYL ESTER
    • Cyclohexanemethanol, alpha,4-dimethyl-, acetate, cis-
    • Cyclohexanemethanol, .alpha.,4-dimethyl-, acetate, cis-
    • Cyclohexanemethanol, alpha,4-dimethyl-, 1-acetate, cis-
    • Cyclohexanemethanol, .alpha.,4-dimethyl-, acetate, trans-
    • Cyclohexanemethanol, alpha,4-dimethyl-, 1-acetate, trans-
    • DTXSID90892971
    • DTXSID90979796
    • GSJZDPJIZODMLX-UHFFFAOYSA-N
    • NS00121726
    • Cyclohexanemethanol, .alpha.,4-dimethyl-, 1-acetate, cis-

  • Applications

    Cyclohexanemethanol, alpha,4-dimethyl-, acetate, trans- (CAS 63573-88-6) is commonly used as a fragrance ingredient and odorant with a fixing effect in perfumery, and also functions as a solvent or co-solvent in cosmetic and household formulations; in industrial contexts it serves as an intermediate for the synthesis of other aroma esters and related chemicals, and may be employed as a processing solvent in coatings and inks, as well as a building block for ester-based polymer applications.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1739.55
    methanol 1851.78
    isopropanol 1956.22
    water 0.85
    ethyl acetate 1275.04
    n-propanol 1383.01
    acetone 1658.23
    n-butanol 1176.65
    acetonitrile 1512.17
    DMF 1260.19
    toluene 595.16
    isobutanol 1052.23
    1,4-dioxane 2273.36
    methyl acetate 1025.64
    THF 2625.68
    2-butanone 1150.44
    n-pentanol 667.01
    sec-butanol 1134.38
    n-hexane 172.45
    ethylene glycol 183.75
    NMP 1026.99
    cyclohexane 298.82
    DMSO 1105.85
    n-butyl acetate 955.92
    n-octanol 350.37
    chloroform 3735.83
    n-propyl acetate 560.83
    acetic acid 920.22
    dichloromethane 2620.82
    cyclohexanone 1661.84
    propylene glycol 417.25
    isopropyl acetate 803.37
    DMAc 776.15
    2-ethoxyethanol 576.67
    isopentanol 1030.35
    n-heptane 81.51
    ethyl formate 695.55
    1,2-dichloroethane 1368.83
    n-hexanol 968.73
    2-methoxyethanol 1164.77
    isobutyl acetate 399.72
    tetrachloromethane 478.9
    n-pentyl acetate 479.43
    transcutol 2366.19
    n-heptanol 321.14
    ethylbenzene 279.78
    MIBK 569.37
    2-propoxyethanol 1070.6
    tert-butanol 1951.41
    MTBE 1453.35
    2-butoxyethanol 490.63
    propionic acid 891.03
    o-xylene 356.7
    formic acid 227.77
    diethyl ether 1163.91
    m-xylene 428.33
    p-xylene 385.6
    chlorobenzene 867.65
    dimethyl carbonate 210.86
    n-octane 38.11
    formamide 327.11
    cyclopentanone 1596.42
    2-pentanone 937.73
    anisole 518.88
    cyclopentyl methyl ether 1038.92
    gamma-butyrolactone 1677.69
    1-methoxy-2-propanol 1080.22
    pyridine 1325.3
    3-pentanone 596.36
    furfural 1159.57
    n-dodecane 32.42
    diethylene glycol 624.51
    diisopropyl ether 342.9
    tert-amyl alcohol 1202.47
    acetylacetone 949.58
    n-hexadecane 37.94
    acetophenone 419.49
    methyl propionate 698.09
    isopentyl acetate 791.76
    trichloroethylene 2435.34
    n-nonanol 293.56
    cyclohexanol 1176.24
    benzyl alcohol 433.91
    2-ethylhexanol 465.27
    isooctanol 268.02
    dipropyl ether 512.46
    1,2-dichlorobenzene 658.61
    ethyl lactate 220.92
    propylene carbonate 950.85
    n-methylformamide 664.75
    2-pentanol 809.75
    n-pentane 144.28
    1-propoxy-2-propanol 826.12
    1-methoxy-2-propyl acetate 769.54
    2-(2-methoxypropoxy) propanol 488.05
    mesitylene 267.61
    ε-caprolactone 1374.87
    p-cymene 185.28
    epichlorohydrin 1744.65
    1,1,1-trichloroethane 1637.7
    2-aminoethanol 514.39
    morpholine-4-carbaldehyde 1113.08
    sulfolane 1433.99
    2,2,4-trimethylpentane 72.83
    2-methyltetrahydrofuran 1901.24
    n-hexyl acetate 691.03
    isooctane 64.11
    2-(2-butoxyethoxy)ethanol 693.83
    sec-butyl acetate 415.03
    tert-butyl acetate 773.44
    decalin 110.04
    glycerin 406.38
    diglyme 1135.1
    acrylic acid 554.57
    isopropyl myristate 248.39
    n-butyric acid 1370.53
    acetyl acetate 688.71
    di(2-ethylhexyl) phthalate 234.12
    ethyl propionate 478.96
    nitromethane 1216.12
    1,2-diethoxyethane 879.82
    benzonitrile 745.33
    trioctyl phosphate 172.89
    1-bromopropane 1082.51
    gamma-valerolactone 1822.77
    n-decanol 213.48
    triethyl phosphate 191.26
    4-methyl-2-pentanol 439.28
    propionitrile 1146.5
    vinylene carbonate 806.58
    1,1,2-trichlorotrifluoroethane 963.15
    DMS 437.36
    cumene 201.08
    2-octanol 251.73
    2-hexanone 592.66
    octyl acetate 312.64
    limonene 315.46
    1,2-dimethoxyethane 1149.02
    ethyl orthosilicate 198.81
    tributyl phosphate 226.07
    diacetone alcohol 746.79
    N,N-dimethylaniline 307.01
    acrylonitrile 1027.0
    aniline 769.32
    1,3-propanediol 772.17
    bromobenzene 971.56
    dibromomethane 1919.93
    1,1,2,2-tetrachloroethane 2088.79
    2-methyl-cyclohexyl acetate 384.04
    tetrabutyl urea 252.31
    diisobutyl methanol 253.42
    2-phenylethanol 500.5
    styrene 372.21
    dioctyl adipate 333.84
    dimethyl sulfate 305.55
    ethyl butyrate 515.27
    methyl lactate 312.95
    butyl lactate 364.29
    diethyl carbonate 305.38
    propanediol butyl ether 518.26
    triethyl orthoformate 316.78
    p-tert-butyltoluene 188.31
    methyl 4-tert-butylbenzoate 396.86
    morpholine 2498.36
    tert-butylamine 1241.76
    n-dodecanol 160.43
    dimethoxymethane 713.03
    ethylene carbonate 763.95
    cyrene 358.64
    2-ethoxyethyl acetate 600.9
    2-ethylhexyl acetate 574.52
    1,2,4-trichlorobenzene 746.04
    4-methylpyridine 1329.71
    dibutyl ether 467.83
    2,6-dimethyl-4-heptanol 253.42
    DEF 802.03
    dimethyl isosorbide 776.52
    tetrachloroethylene 1257.14
    eugenol 371.3
    triacetin 538.05
    span 80 483.16
    1,4-butanediol 255.84
    1,1-dichloroethane 1919.46
    2-methyl-1-pentanol 568.68
    methyl formate 466.14
    2-methyl-1-butanol 840.29
    n-decane 57.57
    butyronitrile 1228.5
    3,7-dimethyl-1-octanol 376.51
    1-chlorooctane 254.76
    1-chlorotetradecane 96.17
    n-nonane 58.88
    undecane 41.77
    tert-butylcyclohexane 108.11
    cyclooctane 78.9
    cyclopentanol 1195.98
    tetrahydropyran 2255.49
    tert-amyl methyl ether 742.22
    2,5,8-trioxanonane 729.46
    1-hexene 582.56
    2-isopropoxyethanol 463.53
    2,2,2-trifluoroethanol 262.34
    methyl butyrate 667.72

    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