Cyclohexanol, methyl-, 1-acetate

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    30232-11-2

    Molecular formula
    C9H16O2

    SMILES
    CC(=O)OC1(CCCCC1)C

  • Odor profile

    Fruity 95.01%
    Floral 75.4%
    Sweet 69.21%
    Woody 44.5%
    Berry 43.25%
    Rose 41.16%
    Herbal 39.31%
    Apple 38.69%
    Mint 38.5%
    Fresh 38.01%

    Scent© AI

  • Properties

    XLogP3-AA
    2.1

    pKa est.
    8.42 (weak base)

    Molecular weight
    156.22 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Fast

    Boiling point est.
    189°C

    Flash point est.
    76.68 ˚C

  • Synonyms

    • Methylcyclohexyl acetate
    • 30232-11-2
    • Cyclohexanol, methyl-, acetate
    • 1-Methylcyclohexyl acetate
    • Cyclohexanol, methyl-, 1-acetate
    • EINECS 250-096-5
    • (1-methylcyclohexyl) acetate
    • Methylcyclohexylacetat
    • 1-Methylcyclohexyl acetate #
    • SCHEMBL183131
    • DTXSID10952607
    • Cyclohexanol, 1-methyl-, acetate
    • NS00049722
    • InChI=1/C9H16O2/c1-8(10)11-9(2)6-4-3-5-7-9/h3-7H2,1-2H

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 645.92
    methanol 1029.9
    isopropanol 690.63
    water 4.7
    ethyl acetate 424.41
    n-propanol 624.29
    acetone 576.34
    n-butanol 531.9
    acetonitrile 578.96
    DMF 768.51
    toluene 378.37
    isobutanol 513.69
    1,4-dioxane 979.52
    methyl acetate 439.51
    THF 1186.83
    2-butanone 444.04
    n-pentanol 328.84
    sec-butanol 587.35
    n-hexane 198.0
    ethylene glycol 184.94
    NMP 834.46
    cyclohexane 332.26
    DMSO 592.8
    n-butyl acetate 366.96
    n-octanol 326.2
    chloroform 2276.17
    n-propyl acetate 234.11
    acetic acid 585.39
    dichloromethane 1475.15
    cyclohexanone 869.53
    propylene glycol 300.58
    isopropyl acetate 284.44
    DMAc 664.08
    2-ethoxyethanol 306.73
    isopentanol 437.87
    n-heptane 134.15
    ethyl formate 339.41
    1,2-dichloroethane 635.33
    n-hexanol 662.27
    2-methoxyethanol 602.94
    isobutyl acetate 179.86
    tetrachloromethane 319.36
    n-pentyl acetate 289.94
    transcutol 919.16
    n-heptanol 254.29
    ethylbenzene 225.43
    MIBK 270.05
    2-propoxyethanol 639.45
    tert-butanol 816.52
    MTBE 490.35
    2-butoxyethanol 303.37
    propionic acid 499.78
    o-xylene 282.07
    formic acid 192.51
    diethyl ether 484.46
    m-xylene 295.79
    p-xylene 298.47
    chlorobenzene 505.48
    dimethyl carbonate 172.53
    n-octane 55.87
    formamide 190.68
    cyclopentanone 835.28
    2-pentanone 391.57
    anisole 351.99
    cyclopentyl methyl ether 576.88
    gamma-butyrolactone 938.47
    1-methoxy-2-propanol 527.38
    pyridine 639.71
    3-pentanone 339.5
    furfural 694.59
    n-dodecane 52.76
    diethylene glycol 435.09
    diisopropyl ether 173.56
    tert-amyl alcohol 615.05
    acetylacetone 437.09
    n-hexadecane 58.92
    acetophenone 293.86
    methyl propionate 370.53
    isopentyl acetate 329.85
    trichloroethylene 1206.52
    n-nonanol 269.09
    cyclohexanol 709.75
    benzyl alcohol 288.45
    2-ethylhexanol 332.69
    isooctanol 203.19
    dipropyl ether 319.35
    1,2-dichlorobenzene 460.03
    ethyl lactate 163.14
    propylene carbonate 569.77
    n-methylformamide 397.2
    2-pentanol 398.25
    n-pentane 178.14
    1-propoxy-2-propanol 446.14
    1-methoxy-2-propyl acetate 350.43
    2-(2-methoxypropoxy) propanol 346.97
    mesitylene 205.19
    ε-caprolactone 731.45
    p-cymene 173.99
    epichlorohydrin 763.22
    1,1,1-trichloroethane 823.46
    2-aminoethanol 346.08
    morpholine-4-carbaldehyde 782.27
    sulfolane 990.91
    2,2,4-trimethylpentane 76.79
    2-methyltetrahydrofuran 802.47
    n-hexyl acetate 506.47
    isooctane 59.07
    2-(2-butoxyethoxy)ethanol 422.34
    sec-butyl acetate 186.8
    tert-butyl acetate 330.39
    decalin 116.94
    glycerin 333.16
    diglyme 618.58
    acrylic acid 408.15
    isopropyl myristate 209.49
    n-butyric acid 607.79
    acetyl acetate 324.48
    di(2-ethylhexyl) phthalate 204.9
    ethyl propionate 254.12
    nitromethane 667.96
    1,2-diethoxyethane 327.65
    benzonitrile 449.45
    trioctyl phosphate 155.97
    1-bromopropane 577.17
    gamma-valerolactone 961.06
    n-decanol 203.54
    triethyl phosphate 159.43
    4-methyl-2-pentanol 224.91
    propionitrile 571.95
    vinylene carbonate 541.76
    1,1,2-trichlorotrifluoroethane 563.5
    DMS 330.35
    cumene 173.65
    2-octanol 219.76
    2-hexanone 277.03
    octyl acetate 260.29
    limonene 274.38
    1,2-dimethoxyethane 584.6
    ethyl orthosilicate 152.57
    tributyl phosphate 184.65
    diacetone alcohol 379.47
    N,N-dimethylaniline 244.86
    acrylonitrile 578.23
    aniline 390.98
    1,3-propanediol 404.28
    bromobenzene 562.58
    dibromomethane 1076.05
    1,1,2,2-tetrachloroethane 1104.3
    2-methyl-cyclohexyl acetate 266.33
    tetrabutyl urea 235.1
    diisobutyl methanol 176.65
    2-phenylethanol 342.75
    styrene 260.38
    dioctyl adipate 270.69
    dimethyl sulfate 281.4
    ethyl butyrate 261.22
    methyl lactate 232.08
    butyl lactate 233.76
    diethyl carbonate 194.03
    propanediol butyl ether 338.38
    triethyl orthoformate 199.59
    p-tert-butyltoluene 173.41
    methyl 4-tert-butylbenzoate 338.18
    morpholine 914.52
    tert-butylamine 610.84
    n-dodecanol 159.52
    dimethoxymethane 466.02
    ethylene carbonate 454.26
    cyrene 275.02
    2-ethoxyethyl acetate 313.7
    2-ethylhexyl acetate 272.46
    1,2,4-trichlorobenzene 496.07
    4-methylpyridine 633.71
    dibutyl ether 304.15
    2,6-dimethyl-4-heptanol 176.65
    DEF 445.01
    dimethyl isosorbide 553.04
    tetrachloroethylene 699.1
    eugenol 293.24
    triacetin 391.58
    span 80 378.38
    1,4-butanediol 180.36
    1,1-dichloroethane 836.64
    2-methyl-1-pentanol 291.41
    methyl formate 334.73
    2-methyl-1-butanol 451.33
    n-decane 82.64
    butyronitrile 545.17
    3,7-dimethyl-1-octanol 297.41
    1-chlorooctane 250.1
    1-chlorotetradecane 108.28
    n-nonane 87.88
    undecane 63.67
    tert-butylcyclohexane 108.87
    cyclooctane 104.04
    cyclopentanol 708.87
    tetrahydropyran 889.62
    tert-amyl methyl ether 365.63
    2,5,8-trioxanonane 507.7
    1-hexene 378.3
    2-isopropoxyethanol 235.67
    2,2,2-trifluoroethanol 200.8
    methyl butyrate 316.04

    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

Botanical

Name CAS Botanical Proportion
Fenugreek 1a headspace 84625-40-1 Trigonella foenum-graecum L., fam. Leguminosae 2.5%
Fenugreek 1b steamdistillate 84625-40-1 Trigonella foenum-graecum L., fam. Leguminosae 2.5%