delta-Terpinyl acetate

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  • Identifiers

    CAS number
    93836-50-1

    Molecular formula
    C12H20O2

    SMILES
    CC(=O)OC(C)(C)C1CCC(=C)CC1

    Safety labels

  • Odor profile

    Fragrance
    Woody 71.76%
    Fruity 68.62%
    Floral 66.16%
    Herbal 65.86%
    Citrus 58.54%
    Spicy 51.61%
    Fresh 49.22%
    Sweet 47.32%
    Green 46.94%
    Lavender 41.53%

     

    Flavor
    Sweet 60.68%
    Herbal 53.51%
    Citrus 50.95%
    Woody 47.62%
    Lavender 43.64%
    Fruity 41.09%
    Floral 36.76%
    Tropical 36.66%
    Bergamot 35.72%
    Mint 33.78%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    2.5

    pKa est.
    9.0 (weak base)

    Molecular weight
    196.29 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderate

    Boiling point est.
    235°C

    Flash point

    • 98.43 ˚C est.

  • Synonyms

    • delta-terpinyl acetate
    • 93836-50-1
    • RefChem:1083127
    • terpiryl acetate
    • delta-terpenyl acetate
    • delta-terpineol acetate
    • .delta.-Terpineol, acetate
    • 2-(4-methylidenecyclohexyl)propan-2-yl acetate
    • Terpinyl acetate, .delta.-
    • Terpineol, .delta.- acetate
    • CHEBI:132829
    • IWKXKWUCSZHJEK-UHFFFAOYSA-N
    • DTXSID001356183
    • FT175236
    • 2-(4-Methylenecyclohexyl)propan-2-yl acetate
    • 1-Methyl-1-(4-methylenecyclohexyl)ethyl acetate
    • Q63408965
    • Cyclohexanemethanol, .alpha.,.alpha.-dimethyl-4-methylene-, acetate
    • 93836-50-1

  • Applications

    delta-Terpinyl acetate is primarily used as a fragrance ingredient and fixative in perfumery, helping to extend and stabilize aroma profiles. It is commonly employed in cosmetics and personal care products as a fragrance component. It is also used in household and cleaning products to impart a pleasant scent. In flavor and aroma applications, it may be evaluated as an aroma chemical for formulation. In coatings, inks, and paints, it can be added to provide odor characteristics. Additionally, it may serve as an intermediate in the synthesis of other aroma compounds within industrial fragrance chemistry.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1343.32
    methanol 1810.0
    isopropanol 1390.23
    water 3.44
    ethyl acetate 912.32
    n-propanol 1026.23
    acetone 1030.15
    n-butanol 974.19
    acetonitrile 1025.66
    DMF 1347.51
    toluene 706.06
    isobutanol 854.25
    1,4-dioxane 2262.58
    methyl acetate 814.83
    THF 2723.02
    2-butanone 737.65
    n-pentanol 564.92
    sec-butanol 953.29
    n-hexane 144.16
    ethylene glycol 196.95
    NMP 1083.91
    cyclohexane 316.63
    DMSO 729.77
    n-butyl acetate 684.78
    n-octanol 389.1
    chloroform 3551.54
    n-propyl acetate 434.2
    acetic acid 854.09
    dichloromethane 2339.37
    cyclohexanone 1325.96
    propylene glycol 460.54
    isopropyl acetate 638.48
    DMAc 940.54
    2-ethoxyethanol 535.74
    isopentanol 855.6
    n-heptane 90.25
    ethyl formate 626.33
    1,2-dichloroethane 1113.7
    n-hexanol 980.61
    2-methoxyethanol 1080.82
    isobutyl acetate 327.84
    tetrachloromethane 417.26
    n-pentyl acetate 411.05
    transcutol 2099.69
    n-heptanol 336.68
    ethylbenzene 314.71
    MIBK 472.64
    2-propoxyethanol 1130.65
    tert-butanol 1665.19
    MTBE 1068.35
    2-butoxyethanol 476.32
    propionic acid 678.14
    o-xylene 383.04
    formic acid 308.48
    diethyl ether 854.02
    m-xylene 483.59
    p-xylene 422.44
    chlorobenzene 825.51
    dimethyl carbonate 291.15
    n-octane 40.72
    formamide 376.12
    cyclopentanone 1218.08
    2-pentanone 666.24
    anisole 536.8
    cyclopentyl methyl ether 983.93
    gamma-butyrolactone 1467.37
    1-methoxy-2-propanol 1059.81
    pyridine 1129.97
    3-pentanone 456.37
    furfural 1117.72
    n-dodecane 37.39
    diethylene glycol 717.46
    diisopropyl ether 303.53
    tert-amyl alcohol 1017.33
    acetylacetone 770.31
    n-hexadecane 42.86
    acetophenone 427.81
    methyl propionate 604.01
    isopentyl acetate 611.41
    trichloroethylene 2080.85
    n-nonanol 335.82
    cyclohexanol 1099.95
    benzyl alcohol 472.42
    2-ethylhexanol 428.26
    isooctanol 262.33
    dipropyl ether 406.96
    1,2-dichlorobenzene 621.42
    ethyl lactate 226.37
    propylene carbonate 909.31
    n-methylformamide 646.77
    2-pentanol 686.37
    n-pentane 145.19
    1-propoxy-2-propanol 752.17
    1-methoxy-2-propyl acetate 699.47
    2-(2-methoxypropoxy) propanol 500.16
    mesitylene 288.49
    ε-caprolactone 1148.12
    p-cymene 197.15
    epichlorohydrin 1571.76
    1,1,1-trichloroethane 1349.16
    2-aminoethanol 491.26
    morpholine-4-carbaldehyde 1282.32
    sulfolane 1121.97
    2,2,4-trimethylpentane 75.6
    2-methyltetrahydrofuran 1682.11
    n-hexyl acetate 672.97
    isooctane 64.25
    2-(2-butoxyethoxy)ethanol 729.39
    sec-butyl acetate 334.59
    tert-butyl acetate 668.07
    decalin 108.57
    glycerin 462.26
    diglyme 1136.21
    acrylic acid 478.66
    isopropyl myristate 246.64
    n-butyric acid 1000.56
    acetyl acetate 624.53
    di(2-ethylhexyl) phthalate 242.3
    ethyl propionate 405.52
    nitromethane 1114.7
    1,2-diethoxyethane 728.79
    benzonitrile 715.71
    trioctyl phosphate 176.01
    1-bromopropane 802.42
    gamma-valerolactone 1614.61
    n-decanol 245.1
    triethyl phosphate 195.71
    4-methyl-2-pentanol 423.12
    propionitrile 834.83
    vinylene carbonate 845.47
    1,1,2-trichlorotrifluoroethane 861.25
    DMS 487.53
    cumene 211.87
    2-octanol 269.66
    2-hexanone 440.18
    octyl acetate 319.89
    limonene 300.9
    1,2-dimethoxyethane 1012.29
    ethyl orthosilicate 196.32
    tributyl phosphate 225.88
    diacetone alcohol 682.54
    N,N-dimethylaniline 352.91
    acrylonitrile 820.62
    aniline 791.45
    1,3-propanediol 702.51
    bromobenzene 871.81
    dibromomethane 1590.31
    1,1,2,2-tetrachloroethane 1863.81
    2-methyl-cyclohexyl acetate 366.01
    tetrabutyl urea 266.61
    diisobutyl methanol 226.13
    2-phenylethanol 579.77
    styrene 369.82
    dioctyl adipate 322.6
    dimethyl sulfate 379.94
    ethyl butyrate 407.13
    methyl lactate 341.02
    butyl lactate 331.08
    diethyl carbonate 291.92
    propanediol butyl ether 556.06
    triethyl orthoformate 297.12
    p-tert-butyltoluene 206.29
    methyl 4-tert-butylbenzoate 429.89
    morpholine 2321.79
    tert-butylamine 1076.15
    n-dodecanol 179.89
    dimethoxymethane 876.88
    ethylene carbonate 763.15
    cyrene 388.37
    2-ethoxyethyl acetate 528.36
    2-ethylhexyl acetate 481.17
    1,2,4-trichlorobenzene 734.1
    4-methylpyridine 1325.85
    dibutyl ether 426.17
    2,6-dimethyl-4-heptanol 226.13
    DEF 666.41
    dimethyl isosorbide 853.73
    tetrachloroethylene 1024.54
    eugenol 387.24
    triacetin 523.57
    span 80 495.95
    1,4-butanediol 254.47
    1,1-dichloroethane 1490.84
    2-methyl-1-pentanol 500.59
    methyl formate 542.04
    2-methyl-1-butanol 743.51
    n-decane 63.75
    butyronitrile 955.02
    3,7-dimethyl-1-octanol 397.45
    1-chlorooctane 251.86
    1-chlorotetradecane 103.76
    n-nonane 62.86
    undecane 47.02
    tert-butylcyclohexane 102.66
    cyclooctane 83.16
    cyclopentanol 1072.13
    tetrahydropyran 1947.4
    tert-amyl methyl ether 623.89
    2,5,8-trioxanonane 809.18
    1-hexene 408.98
    2-isopropoxyethanol 412.97
    2,2,2-trifluoroethanol 298.47
    methyl butyrate 500.72

    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