Myaldyl acetate

Overview IFRA Request a quote

  • Identifiers

    CAS number
    72403-67-9

    Molecular formula
    C15H24O2

    SMILES
    CC(=CCCC1=CCC[C@@H](C1)COC(=O)C)C

    Safety labels

    Irritant
    Irritant

    Environmental Hazard
    Environmental

  • Odor profile

    Fragrance
    Floral 83.63%
    Green 66.71%
    Sweet 66.08%
    Fresh 62.11%
    Citrus 58.63%
    Fruity 56.66%
    Rose 52.36%
    Waxy 44.93%
    Herbal 39.53%
    Lily 39.31%

     

    Flavor
    Floral 52.54%
    Rose 43.29%
    Green 40.93%
    Spicy 39.6%
    Fruity 37.9%
    Herbal 37.81%
    Fresh 36.21%
    Sweet 29.79%
    Waxy 29.46%
    Tropical 29.19%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    3.7

    pKa est.
    8.78 (weak base)

    Molecular weight
    236.35 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    294°C

    Flash point

    • 139.06 ˚C est.

  • Synonyms

    • Myraldyl acetate
    • Myaldyl acetate
    • EINECS 276-650-6
    • 3(Or 4)-(4-methylpenten-3-yl)cyclohex-3-ene-1-methyl acetate
    • 72403-67-9
    • [(1S)-3-(4-methylpent-3-enyl)cyclohex-3-en-1-yl]methyl acetate
    • 4-(4-Methyl-3-pentenyl)-3-cyclohexen-1-ylmethyl acetate
    • 3-Cyclohexene-1-methanol, 3(or 4)-(4-methyl-3-pentenyl)-, acetate
    • 3-Cyclohexene-1-methanol, 3(or 4)-(4-methyl-3-penten-1-yl)-, 1-acetate
    • DTXSID5052466
    • SCHEMBL3504508
    • DTXCID2031039
    • IIUKCYITROTKFB-HNNXBMFYSA-N
    • NS00012965
    • 276-650-6

  • Applications

    Myaldyl acetate, CAS 72403-67-9, is a fatty ester commonly used as an emollient and solvent in cosmetics and personal care; it also serves as a fragrance ingredient or fixative in perfumery. In industrial formulations, it is often employed as a plasticizer and processing aid for polymers and coatings, and as a solvent or plasticizer in inks and adhesives.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 603.93
    methanol 403.1
    isopropanol 517.96
    water 0.06
    ethyl acetate 600.6
    n-propanol 441.25
    acetone 358.14
    n-butanol 484.65
    acetonitrile 249.89
    DMF 250.5
    toluene 331.57
    isobutanol 292.49
    1,4-dioxane 1001.28
    methyl acetate 339.55
    THF 955.02
    2-butanone 425.68
    n-pentanol 339.65
    sec-butanol 433.92
    n-hexane 64.63
    ethylene glycol 28.16
    NMP 200.63
    cyclohexane 89.31
    DMSO 300.46
    n-butyl acetate 353.0
    n-octanol 104.63
    chloroform 1350.03
    n-propyl acetate 297.94
    acetic acid 200.88
    dichloromethane 928.76
    cyclohexanone 449.87
    propylene glycol 110.64
    isopropyl acetate 400.26
    DMAc 421.57
    2-ethoxyethanol 430.7
    isopentanol 384.24
    n-heptane 22.02
    ethyl formate 162.13
    1,2-dichloroethane 573.6
    n-hexanol 353.49
    2-methoxyethanol 528.41
    isobutyl acetate 234.41
    tetrachloromethane 112.64
    n-pentyl acetate 177.5
    transcutol 2070.72
    n-heptanol 112.46
    ethylbenzene 159.14
    MIBK 280.56
    2-propoxyethanol 560.77
    tert-butanol 538.1
    MTBE 645.12
    2-butoxyethanol 241.03
    propionic acid 162.39
    o-xylene 163.92
    formic acid 43.97
    diethyl ether 827.1
    m-xylene 214.66
    p-xylene 171.89
    chlorobenzene 262.48
    dimethyl carbonate 82.08
    n-octane 9.53
    formamide 68.38
    cyclopentanone 339.3
    2-pentanone 385.75
    anisole 309.08
    cyclopentyl methyl ether 465.41
    gamma-butyrolactone 313.52
    1-methoxy-2-propanol 501.48
    pyridine 472.58
    3-pentanone 269.96
    furfural 312.91
    n-dodecane 8.21
    diethylene glycol 272.02
    diisopropyl ether 185.24
    tert-amyl alcohol 405.27
    acetylacetone 354.04
    n-hexadecane 9.74
    acetophenone 231.51
    methyl propionate 282.96
    isopentyl acetate 351.22
    trichloroethylene 916.8
    n-nonanol 103.98
    cyclohexanol 319.59
    benzyl alcohol 224.17
    2-ethylhexanol 184.58
    isooctanol 98.31
    dipropyl ether 244.84
    1,2-dichlorobenzene 242.0
    ethyl lactate 120.83
    propylene carbonate 216.33
    n-methylformamide 107.03
    2-pentanol 345.85
    n-pentane 47.39
    1-propoxy-2-propanol 397.51
    1-methoxy-2-propyl acetate 417.32
    2-(2-methoxypropoxy) propanol 317.3
    mesitylene 125.43
    ε-caprolactone 417.2
    p-cymene 81.83
    epichlorohydrin 650.61
    1,1,1-trichloroethane 511.64
    2-aminoethanol 126.99
    morpholine-4-carbaldehyde 418.43
    sulfolane 287.54
    2,2,4-trimethylpentane 29.59
    2-methyltetrahydrofuran 776.55
    n-hexyl acetate 264.93
    isooctane 24.91
    2-(2-butoxyethoxy)ethanol 457.02
    sec-butyl acetate 277.89
    tert-butyl acetate 391.16
    decalin 48.23
    glycerin 116.06
    diglyme 738.2
    acrylic acid 97.85
    isopropyl myristate 105.62
    n-butyric acid 345.07
    acetyl acetate 267.58
    di(2-ethylhexyl) phthalate 106.57
    ethyl propionate 248.0
    nitromethane 242.78
    1,2-diethoxyethane 674.32
    benzonitrile 231.53
    trioctyl phosphate 64.41
    1-bromopropane 457.2
    gamma-valerolactone 527.17
    n-decanol 76.53
    triethyl phosphate 113.36
    4-methyl-2-pentanol 188.54
    propionitrile 264.91
    vinylene carbonate 188.38
    1,1,2-trichlorotrifluoroethane 356.53
    DMS 209.56
    cumene 107.13
    2-octanol 73.68
    2-hexanone 294.81
    octyl acetate 125.76
    limonene 123.22
    1,2-dimethoxyethane 612.16
    ethyl orthosilicate 123.11
    tributyl phosphate 94.73
    diacetone alcohol 334.12
    N,N-dimethylaniline 190.09
    acrylonitrile 213.85
    aniline 301.6
    1,3-propanediol 255.77
    bromobenzene 306.21
    dibromomethane 676.02
    1,1,2,2-tetrachloroethane 870.66
    2-methyl-cyclohexyl acetate 205.23
    tetrabutyl urea 108.63
    diisobutyl methanol 103.73
    2-phenylethanol 238.33
    styrene 198.15
    dioctyl adipate 159.35
    dimethyl sulfate 101.24
    ethyl butyrate 241.34
    methyl lactate 112.75
    butyl lactate 150.41
    diethyl carbonate 158.22
    propanediol butyl ether 244.32
    triethyl orthoformate 188.29
    p-tert-butyltoluene 83.46
    methyl 4-tert-butylbenzoate 200.99
    morpholine 1141.3
    tert-butylamine 330.39
    n-dodecanol 56.71
    dimethoxymethane 340.34
    ethylene carbonate 176.65
    cyrene 194.97
    2-ethoxyethyl acetate 321.27
    2-ethylhexyl acetate 271.44
    1,2,4-trichlorobenzene 296.2
    4-methylpyridine 512.39
    dibutyl ether 207.63
    2,6-dimethyl-4-heptanol 103.73
    DEF 342.81
    dimethyl isosorbide 412.58
    tetrachloroethylene 455.27
    eugenol 190.52
    triacetin 280.54
    span 80 246.77
    1,4-butanediol 95.88
    1,1-dichloroethane 643.95
    2-methyl-1-pentanol 302.88
    methyl formate 63.24
    2-methyl-1-butanol 343.53
    n-decane 15.46
    butyronitrile 326.97
    3,7-dimethyl-1-octanol 143.84
    1-chlorooctane 81.68
    1-chlorotetradecane 30.6
    n-nonane 14.18
    undecane 10.77
    tert-butylcyclohexane 44.75
    cyclooctane 27.34
    cyclopentanol 215.09
    tetrahydropyran 995.93
    tert-amyl methyl ether 404.58
    2,5,8-trioxanonane 505.59
    1-hexene 252.8
    2-isopropoxyethanol 348.59
    2,2,2-trifluoroethanol 46.0
    methyl butyrate 297.72

    Scent© AI

1 4

IFRA standard 51

Recommendation
Restriction
Maximum acceptable concentrations in the finished product (%)
Category 1
Products applied to the lips
 0.077 % Category 7A
Rinse-off products applied to the hair with some hand contact
 0.88 %
Category 2
Products applied to the axillae
 0.023 % Category 7B
Leave-on products applied to the hair with some hand contact
 0.88 %
Category 3
Products applied to the face/body using fingertips
 0.46 % Category 8
Products with significant anogenital exposure
 0.045 %
Category 4
Products related to fine fragrance
 0.43 % Category 9
Products with body and hand exposure, primarily rinse off
 0.84 %
Category 5A
Body lotion products applied to the body using the hands (palms), primarily leave on
 0.11 % Category 10A
Household care products with mostly hand contact
 3 %
Category 5B
Face moisturizer products applied to the face using the hands (palms), primarily leave on
 0.11 % Category 10B
Household care products with mostly hand contact, including aerosol/spray products (with potential leave-on skin contact)
 3 %
Category 5C
Hand cream products applied to the hands using the hands (palms), primarily leave on
 0.11 % Category 11A
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate without UV exposure
 1.7 %
Category 5D
Baby Creams, baby Oils and baby talc
 0.11 % Category 11B
Products with intended skin contact but minimal transfer of fragrance to skin from inert substrate with potential UV exposure
 1.7 %
Category 6
Products with oral and lip exposure
 0.25 % Category 12
Products not intended for direct skin contact, minimal or insignificant transfer to skin
 No restriction