alpha-Terpinyl acetate, (-)-

Overview IFRA Request a quote

  • Identifiers

    CAS number
    58206-95-4

    Molecular formula
    C12H20O2

    SMILES
    CC1=CC[C@H](CC1)C(C)(C)OC(=O)C

    Safety labels

    Environmental Hazard
    Environmental

  • Odor profile

    Fragrance
    Herbal 75.39%
    Citrus 70.85%
    Woody 68.8%
    Floral 68.17%
    Sweet 65.8%
    Fruity 64.18%
    Spicy 60.8%
    Fresh 54.07%
    Green 53.7%
    Bergamot 49.61%

     

    Flavor
    Sweet 68.09%
    Herbal 64.9%
    Citrus 60.93%
    Lavender 48.58%
    Pine 40.85%
    Woody 39.37%
    Bergamot 38.11%
    Bitter 37.71%
    Tropical 35.05%
    Fruity 34.34%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    2.4

    pKa est.
    9.31 (weak base)

    Molecular weight
    196.29 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately slow

    Boiling point est.
    231°C

    Flash point

    • 102.35 ˚C est.

  • Synonyms

    • 1-alpha-Terpinyl acetate
    • 496J6JBI0K
    • alpha-Terpinyl acetate, (-)-
    • EINECS 261-165-4
    • 3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, 1-acetate, (1S)-
    • (S)-.ALPHA.-TERPINYL ACETATE
    • .ALPHA.-TERPINYL ACETATE, (-)-
    • 3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, acetate, (S)-
    • 3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, acetate, (1S)-
    • 3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, acetate, (1S)-
    • 3-Cyclohexene-1-methanol, alpha,alpha,4-trimethyl-, acetate, (S)-
    • 3-Cyclohexene-1-methanol, .alpha.,.alpha.,4-trimethyl-, 1-acetate, (1S)-
    • 1-Methyl-1-((1S)-4-methyl-3-cyclohexen-1-yl)ethyl acetate
    • 1-Methyl-1-[(1S)-4-methyl-3-cyclohexen-1-yl]ethyl acetate
    • RefChem:555952
    • (S)-ALPHA-TERPINYL ACETATE
    • 58206-95-4
    • 2-[(1S)-4-methylcyclohex-3-en-1-yl]propan-2-yl acetate
    • UNII-496J6JBI0K
    • 1S-Terpinyl Acetate
    • (-)-alpha-terpinyl acetate
    • DTXSID1052242
    • SCHEMBL18316481
    • IGODOXYLBBXFDW-LLVKDONJSA-N
    • (S)-alpha,alpha,4-Trimethylcyclohex-3-ene-1-methyl acetate
    • NS00122206
    • Q27259234
    • 58206-95-4

  • Applications

    alpha-Terpinyl acetate, (-)- (CAS 58206-95-4) is a fragrance ingredient primarily used as an aroma component and may function as a fixative in formulations. Practical applications span perfumery and cosmetics (fragrances for perfumes, soaps, shampoos, and creams), flavoring for foods and beverages within permitted limits, odorant use in household products and cleaning formulations (air fresheners and cleaners), and as a fragrance additive in coatings, inks, and adhesives. It may also serve as an intermediate in the synthesis of additional fragrance materials.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 790.81
    methanol 1000.4
    isopropanol 815.93
    water 4.23
    ethyl acetate 565.97
    n-propanol 622.28
    acetone 568.16
    n-butanol 586.86
    acetonitrile 639.75
    DMF 835.31
    toluene 488.31
    isobutanol 520.57
    1,4-dioxane 1556.72
    methyl acetate 544.57
    THF 1459.93
    2-butanone 482.77
    n-pentanol 375.77
    sec-butanol 602.79
    n-hexane 131.35
    ethylene glycol 156.23
    NMP 748.78
    cyclohexane 251.26
    DMSO 447.26
    n-butyl acetate 409.04
    n-octanol 337.59
    chloroform 2032.28
    n-propyl acetate 265.93
    acetic acid 514.16
    dichloromethane 1308.85
    cyclohexanone 800.14
    propylene glycol 326.09
    isopropyl acetate 368.75
    DMAc 732.67
    2-ethoxyethanol 401.47
    isopentanol 543.18
    n-heptane 77.26
    ethyl formate 335.12
    1,2-dichloroethane 626.05
    n-hexanol 689.34
    2-methoxyethanol 753.53
    isobutyl acetate 209.41
    tetrachloromethane 268.35
    n-pentyl acetate 282.48
    transcutol 1556.5
    n-heptanol 268.85
    ethylbenzene 236.98
    MIBK 298.63
    2-propoxyethanol 823.5
    tert-butanol 979.1
    MTBE 697.71
    2-butoxyethanol 366.28
    propionic acid 452.44
    o-xylene 299.58
    formic acid 191.29
    diethyl ether 572.81
    m-xylene 362.78
    p-xylene 311.2
    chlorobenzene 504.98
    dimethyl carbonate 195.23
    n-octane 37.24
    formamide 238.59
    cyclopentanone 713.46
    2-pentanone 407.78
    anisole 400.77
    cyclopentyl methyl ether 639.07
    gamma-butyrolactone 827.91
    1-methoxy-2-propanol 716.27
    pyridine 667.79
    3-pentanone 328.9
    furfural 666.73
    n-dodecane 36.1
    diethylene glycol 540.44
    diisopropyl ether 217.23
    tert-amyl alcohol 701.37
    acetylacetone 457.28
    n-hexadecane 40.82
    acetophenone 321.04
    methyl propionate 414.48
    isopentyl acetate 384.67
    trichloroethylene 1171.21
    n-nonanol 293.03
    cyclohexanol 717.76
    benzyl alcohol 343.09
    2-ethylhexanol 333.25
    isooctanol 209.78
    dipropyl ether 291.03
    1,2-dichlorobenzene 420.05
    ethyl lactate 170.89
    propylene carbonate 536.36
    n-methylformamide 364.81
    2-pentanol 440.36
    n-pentane 122.3
    1-propoxy-2-propanol 540.71
    1-methoxy-2-propyl acetate 476.81
    2-(2-methoxypropoxy) propanol 417.87
    mesitylene 225.11
    ε-caprolactone 740.04
    p-cymene 153.83
    epichlorohydrin 857.36
    1,1,1-trichloroethane 810.84
    2-aminoethanol 360.93
    morpholine-4-carbaldehyde 926.43
    sulfolane 685.59
    2,2,4-trimethylpentane 68.23
    2-methyltetrahydrofuran 1040.4
    n-hexyl acetate 509.24
    isooctane 52.77
    2-(2-butoxyethoxy)ethanol 587.93
    sec-butyl acetate 223.8
    tert-butyl acetate 413.83
    decalin 97.4
    glycerin 344.66
    diglyme 824.77
    acrylic acid 338.46
    isopropyl myristate 196.69
    n-butyric acid 582.98
    acetyl acetate 385.52
    di(2-ethylhexyl) phthalate 195.69
    ethyl propionate 275.05
    nitromethane 641.66
    1,2-diethoxyethane 505.1
    benzonitrile 454.76
    trioctyl phosphate 142.96
    1-bromopropane 500.02
    gamma-valerolactone 1009.61
    n-decanol 217.05
    triethyl phosphate 150.09
    4-methyl-2-pentanol 294.89
    propionitrile 504.84
    vinylene carbonate 498.05
    1,1,2-trichlorotrifluoroethane 582.81
    DMS 352.46
    cumene 172.02
    2-octanol 216.82
    2-hexanone 282.61
    octyl acetate 259.1
    limonene 239.56
    1,2-dimethoxyethane 678.74
    ethyl orthosilicate 153.1
    tributyl phosphate 171.42
    diacetone alcohol 468.0
    N,N-dimethylaniline 277.27
    acrylonitrile 475.14
    aniline 516.82
    1,3-propanediol 476.84
    bromobenzene 540.39
    dibromomethane 896.53
    1,1,2,2-tetrachloroethane 1069.28
    2-methyl-cyclohexyl acetate 270.41
    tetrabutyl urea 207.07
    diisobutyl methanol 167.43
    2-phenylethanol 425.09
    styrene 270.38
    dioctyl adipate 251.03
    dimethyl sulfate 265.32
    ethyl butyrate 273.02
    methyl lactate 246.07
    butyl lactate 230.4
    diethyl carbonate 201.64
    propanediol butyl ether 462.62
    triethyl orthoformate 210.18
    p-tert-butyltoluene 161.62
    methyl 4-tert-butylbenzoate 334.81
    morpholine 1522.16
    tert-butylamine 674.89
    n-dodecanol 164.19
    dimethoxymethane 581.34
    ethylene carbonate 439.99
    cyrene 312.12
    2-ethoxyethyl acetate 373.54
    2-ethylhexyl acetate 317.58
    1,2,4-trichlorobenzene 504.47
    4-methylpyridine 782.19
    dibutyl ether 309.91
    2,6-dimethyl-4-heptanol 167.43
    DEF 450.13
    dimethyl isosorbide 617.48
    tetrachloroethylene 599.08
    eugenol 296.36
    triacetin 415.5
    span 80 400.82
    1,4-butanediol 190.88
    1,1-dichloroethane 854.36
    2-methyl-1-pentanol 369.15
    methyl formate 291.24
    2-methyl-1-butanol 496.19
    n-decane 59.01
    butyronitrile 552.75
    3,7-dimethyl-1-octanol 322.84
    1-chlorooctane 203.23
    1-chlorotetradecane 90.51
    n-nonane 58.54
    undecane 44.88
    tert-butylcyclohexane 94.45
    cyclooctane 78.84
    cyclopentanol 641.64
    tetrahydropyran 1201.23
    tert-amyl methyl ether 468.37
    2,5,8-trioxanonane 611.34
    1-hexene 304.31
    2-isopropoxyethanol 310.23
    2,2,2-trifluoroethanol 195.04
    methyl butyrate 315.87

    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