Acetaldehyde benzyl hexyl acetal

  • Identifiers

    Molecular formula
    C15H24O2

    SMILES
    CCCCCCOC(C)OCC1=CC=CC=C1

  • Odor profile

    Fragrance
    Green 91.8%
    Fruity 75.9%
    Sweet 67.26%
    Herbal 50.73%
    Floral 45.3%
    Leafy 39.75%
    Vegetable 39.26%
    Earthy 37.64%
    Fresh 34.11%
    Almond 32.74%

     

    Flavor
    Green 73.48%
    Fruity 59.46%
    Floral 57.67%
    Earthy 44.28%
    Rose 40.71%
    Mushroom 38.31%
    Waxy 30.76%
    Spicy 30.62%
    Tropical 30.54%
    Sweet 30.44%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    4.3

    pKa est.
    6.99 (neutral)

    Molecular weight
    236.35 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very slow

    Boiling point est.
    286°C

    Flash point

    • 123.29 ˚C est.

  • Synonyms

    • ACETALDEHYDE BENZYL HEXYL ACETAL
  • Applications

    Acetaldehyde benzyl hexyl acetal is a fragrance-related compound primarily used as a fragrance intermediate and fixative to extend scent in perfumery; it can also function as an aroma compound in flavors. In cosmetics and personal care, it is used as a fragrance ingredient in products such as creams and shampoos. In household products, it provides fragrance in cleaners and air fresheners. In coatings and inks, it may be used as a fragrance additive or processing aid to impart scent in packaged products. In industrial manufacturing, it is employed as an intermediate in the synthesis of other fragrance-related compounds.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 3636.45
    methanol 2987.59
    isopropanol 2399.55
    water 0.29
    ethyl acetate 5728.12
    n-propanol 2847.62
    acetone 4201.17
    n-butanol 2841.8
    acetonitrile 3800.17
    DMF 1514.69
    toluene 1487.27
    isobutanol 2056.0
    1,4-dioxane 5299.61
    methyl acetate 3205.35
    THF 4234.07
    2-butanone 3217.89
    n-pentanol 2006.03
    sec-butanol 2309.76
    n-hexane 830.36
    ethylene glycol 202.32
    NMP 1044.93
    cyclohexane 1608.86
    DMSO 3693.28
    n-butyl acetate 3628.75
    n-octanol 603.24
    chloroform 9214.36
    n-propyl acetate 3255.62
    acetic acid 2125.03
    dichloromethane 10928.12
    cyclohexanone 3954.9
    propylene glycol 354.1
    isopropyl acetate 3025.29
    DMAc 1670.74
    2-ethoxyethanol 2112.14
    isopentanol 2253.32
    n-heptane 476.25
    ethyl formate 1927.51
    1,2-dichloroethane 7375.61
    n-hexanol 1920.82
    2-methoxyethanol 2450.09
    isobutyl acetate 1650.24
    tetrachloromethane 1377.26
    n-pentyl acetate 1561.92
    transcutol 5958.55
    n-heptanol 603.88
    ethylbenzene 826.31
    MIBK 1633.3
    2-propoxyethanol 2147.7
    tert-butanol 2592.03
    MTBE 3777.28
    2-butoxyethanol 1052.9
    propionic acid 1604.86
    o-xylene 813.03
    formic acid 349.2
    diethyl ether 6364.03
    m-xylene 815.73
    p-xylene 1015.74
    chlorobenzene 1972.11
    dimethyl carbonate 673.25
    n-octane 146.27
    formamide 584.36
    cyclopentanone 2524.11
    2-pentanone 3070.34
    anisole 1432.85
    cyclopentyl methyl ether 2544.23
    gamma-butyrolactone 2651.08
    1-methoxy-2-propanol 1759.3
    pyridine 3527.4
    3-pentanone 2262.98
    furfural 1962.77
    n-dodecane 85.23
    diethylene glycol 979.43
    diisopropyl ether 1307.12
    tert-amyl alcohol 2050.22
    acetylacetone 2680.09
    n-hexadecane 99.16
    acetophenone 1229.51
    methyl propionate 2485.8
    isopentyl acetate 2647.88
    trichloroethylene 8716.0
    n-nonanol 528.67
    cyclohexanol 2236.05
    benzyl alcohol 943.3
    2-ethylhexanol 1268.57
    isooctanol 521.06
    dipropyl ether 2744.9
    1,2-dichlorobenzene 1707.33
    ethyl lactate 674.62
    propylene carbonate 1816.5
    n-methylformamide 918.68
    2-pentanol 1928.24
    n-pentane 635.28
    1-propoxy-2-propanol 1720.68
    1-methoxy-2-propyl acetate 1937.34
    2-(2-methoxypropoxy) propanol 819.92
    mesitylene 553.5
    ε-caprolactone 3236.23
    p-cymene 476.42
    epichlorohydrin 4590.25
    1,1,1-trichloroethane 4869.64
    2-aminoethanol 631.02
    morpholine-4-carbaldehyde 1788.48
    sulfolane 2421.96
    2,2,4-trimethylpentane 219.29
    2-methyltetrahydrofuran 3793.61
    n-hexyl acetate 1656.0
    isooctane 169.97
    2-(2-butoxyethoxy)ethanol 1246.11
    sec-butyl acetate 1984.11
    tert-butyl acetate 2303.59
    decalin 411.47
    glycerin 388.82
    diglyme 2822.58
    acrylic acid 944.86
    isopropyl myristate 571.45
    n-butyric acid 3277.86
    acetyl acetate 2544.1
    di(2-ethylhexyl) phthalate 377.06
    ethyl propionate 2447.64
    nitromethane 3449.05
    1,2-diethoxyethane 3810.88
    benzonitrile 1361.4
    trioctyl phosphate 303.06
    1-bromopropane 4838.43
    gamma-valerolactone 3064.6
    n-decanol 361.02
    triethyl phosphate 690.99
    4-methyl-2-pentanol 863.1
    propionitrile 2618.47
    vinylene carbonate 1589.65
    1,1,2-trichlorotrifluoroethane 2191.42
    DMS 1087.36
    cumene 494.93
    2-octanol 425.44
    2-hexanone 2347.16
    octyl acetate 642.4
    limonene 910.87
    1,2-dimethoxyethane 3987.27
    ethyl orthosilicate 753.13
    tributyl phosphate 479.46
    diacetone alcohol 1369.67
    N,N-dimethylaniline 758.42
    acrylonitrile 2021.22
    aniline 1417.18
    1,3-propanediol 1161.65
    bromobenzene 2441.5
    dibromomethane 7266.66
    1,1,2,2-tetrachloroethane 7247.99
    2-methyl-cyclohexyl acetate 1123.0
    tetrabutyl urea 565.45
    diisobutyl methanol 642.66
    2-phenylethanol 947.65
    styrene 1213.1
    dioctyl adipate 763.73
    dimethyl sulfate 787.37
    ethyl butyrate 2580.11
    methyl lactate 559.19
    butyl lactate 818.72
    diethyl carbonate 1486.01
    propanediol butyl ether 693.18
    triethyl orthoformate 1421.83
    p-tert-butyltoluene 423.33
    methyl 4-tert-butylbenzoate 747.85
    morpholine 5693.63
    tert-butylamine 1814.95
    n-dodecanol 276.33
    dimethoxymethane 2153.8
    ethylene carbonate 1741.01
    cyrene 581.26
    2-ethoxyethyl acetate 1859.98
    2-ethylhexyl acetate 2019.73
    1,2,4-trichlorobenzene 1732.88
    4-methylpyridine 2968.66
    dibutyl ether 1893.31
    2,6-dimethyl-4-heptanol 642.66
    DEF 2796.99
    dimethyl isosorbide 1293.56
    tetrachloroethylene 4811.88
    eugenol 668.4
    triacetin 1258.66
    span 80 767.16
    1,4-butanediol 527.31
    1,1-dichloroethane 6170.34
    2-methyl-1-pentanol 1596.06
    methyl formate 734.72
    2-methyl-1-butanol 2048.11
    n-decane 169.69
    butyronitrile 3240.71
    3,7-dimethyl-1-octanol 649.62
    1-chlorooctane 675.89
    1-chlorotetradecane 218.77
    n-nonane 186.32
    undecane 111.24
    tert-butylcyclohexane 323.14
    cyclooctane 354.4
    cyclopentanol 1410.55
    tetrahydropyran 6802.64
    tert-amyl methyl ether 2043.17
    2,5,8-trioxanonane 1560.3
    1-hexene 2484.31
    2-isopropoxyethanol 1502.12
    2,2,2-trifluoroethanol 524.98
    methyl butyrate 3389.16

    Scent© AI

1 of 4
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