1-Acetyloxybutan-2-yl butanoate

  • Identifiers

    Molecular formula
    C10H18O4

    SMILES
    CCCC(=O)OC(CC)COC(=O)C

  • Odor profile

    Fragrance
    Fruity 93.38%
    Sweet 49.17%
    Winey 42.19%
    Buttery 40.53%
    Pineapple 36.05%
    Caramellic 35.42%
    Apple 34.63%
    Tropical 33.32%
    Creamy 32.72%
    Fatty 32.13%

     

    Flavor
    Fruity 87.45%
    Bitter 43.37%
    Tropical 43.34%
    Sweet 42.43%
    Fruit 41.53%
    Pineapple 41.13%
    Apple 38.58%
    Grape 37.6%
    Green 36.83%
    Creamy 35.49%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    1.8

    pKa est.
    7.82 (neutral)

    Molecular weight
    202.25 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately slow

    Boiling point est.
    227°C

    Flash point

    • 108.14 ˚C est.

  • Synonyms

    • SCHEMBL10168220
  • Applications

    1-Acetyloxybutan-2-yl butanoate is used primarily as a fragrance ingredient and fragrance fixative in perfumery and cosmetics, helping to stabilize and extend aroma. It is also considered an aroma component in personal care products such as lotions and soaps, contributing a distinctive scent profile. In household and cleaning products, it can serve as a fragrance additive and, in some formulations, as a lightweight solvent. It is commonly regarded as a precursor or intermediate in the synthesis of additional fragrance materials. In polymer and coating contexts, 1-Acetyloxybutan-2-yl butanoate can be used as a solvent or additive in certain formulations.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1189.01
    methanol 1983.91
    isopropanol 874.37
    water 5.36
    ethyl acetate 543.83
    n-propanol 782.33
    acetone 1344.32
    n-butanol 660.32
    acetonitrile 1015.97
    DMF 1761.49
    toluene 295.07
    isobutanol 591.99
    1,4-dioxane 1094.28
    methyl acetate 613.26
    THF 1068.73
    2-butanone 717.02
    n-pentanol 523.89
    sec-butanol 784.02
    n-hexane 39.34
    ethylene glycol 228.87
    NMP 1381.92
    cyclohexane 64.18
    DMSO 2133.36
    n-butyl acetate 399.61
    n-octanol 146.81
    chloroform 1822.26
    n-propyl acetate 350.07
    acetic acid 2130.84
    dichloromethane 1775.55
    cyclohexanone 1045.21
    propylene glycol 305.77
    isopropyl acetate 350.84
    DMAc 1666.43
    2-ethoxyethanol 742.03
    isopentanol 543.97
    n-heptane 10.89
    ethyl formate 605.05
    1,2-dichloroethane 968.82
    n-hexanol 308.01
    2-methoxyethanol 1198.19
    isobutyl acetate 239.18
    tetrachloromethane 161.58
    n-pentyl acetate 233.1
    transcutol 1211.93
    n-heptanol 117.89
    ethylbenzene 198.51
    MIBK 303.13
    2-propoxyethanol 509.4
    tert-butanol 987.7
    MTBE 566.97
    2-butoxyethanol 269.8
    propionic acid 764.39
    o-xylene 221.14
    formic acid 767.55
    diethyl ether 431.09
    m-xylene 184.94
    p-xylene 304.19
    chlorobenzene 544.62
    dimethyl carbonate 187.71
    n-octane 8.37
    formamide 824.98
    cyclopentanone 1065.43
    2-pentanone 486.62
    anisole 408.53
    cyclopentyl methyl ether 423.9
    gamma-butyrolactone 1269.19
    1-methoxy-2-propanol 686.15
    pyridine 993.45
    3-pentanone 349.26
    furfural 1265.21
    n-dodecane 9.57
    diethylene glycol 448.92
    diisopropyl ether 94.42
    tert-amyl alcohol 832.73
    acetylacetone 679.45
    n-hexadecane 11.02
    acetophenone 454.78
    methyl propionate 385.44
    isopentyl acetate 361.8
    trichloroethylene 1807.97
    n-nonanol 122.26
    cyclohexanol 618.99
    benzyl alcohol 481.57
    2-ethylhexanol 170.87
    isooctanol 99.56
    dipropyl ether 127.14
    1,2-dichlorobenzene 483.86
    ethyl lactate 185.41
    propylene carbonate 707.06
    n-methylformamide 915.91
    2-pentanol 375.02
    n-pentane 28.57
    1-propoxy-2-propanol 308.11
    1-methoxy-2-propyl acetate 316.82
    2-(2-methoxypropoxy) propanol 306.17
    mesitylene 105.07
    ε-caprolactone 899.67
    p-cymene 90.45
    epichlorohydrin 1157.15
    1,1,1-trichloroethane 756.0
    2-aminoethanol 480.97
    morpholine-4-carbaldehyde 1134.2
    sulfolane 1475.86
    2,2,4-trimethylpentane 25.76
    2-methyltetrahydrofuran 850.55
    n-hexyl acetate 336.87
    isooctane 13.03
    2-(2-butoxyethoxy)ethanol 389.89
    sec-butyl acetate 239.66
    tert-butyl acetate 338.4
    decalin 43.94
    glycerin 403.65
    diglyme 737.97
    acrylic acid 698.13
    isopropyl myristate 110.23
    n-butyric acid 949.67
    acetyl acetate 458.85
    di(2-ethylhexyl) phthalate 150.04
    ethyl propionate 283.28
    nitromethane 2069.37
    1,2-diethoxyethane 360.22
    benzonitrile 595.93
    trioctyl phosphate 95.03
    1-bromopropane 490.89
    gamma-valerolactone 1365.58
    n-decanol 85.1
    triethyl phosphate 142.54
    4-methyl-2-pentanol 183.45
    propionitrile 621.28
    vinylene carbonate 704.49
    1,1,2-trichlorotrifluoroethane 988.79
    DMS 290.08
    cumene 128.42
    2-octanol 97.63
    2-hexanone 386.91
    octyl acetate 153.83
    limonene 132.25
    1,2-dimethoxyethane 1178.51
    ethyl orthosilicate 126.64
    tributyl phosphate 140.79
    diacetone alcohol 422.71
    N,N-dimethylaniline 284.05
    acrylonitrile 791.47
    aniline 475.06
    1,3-propanediol 700.86
    bromobenzene 543.18
    dibromomethane 1096.77
    1,1,2,2-tetrachloroethane 1526.86
    2-methyl-cyclohexyl acetate 225.09
    tetrabutyl urea 173.4
    diisobutyl methanol 91.23
    2-phenylethanol 297.99
    styrene 276.3
    dioctyl adipate 203.46
    dimethyl sulfate 396.15
    ethyl butyrate 246.14
    methyl lactate 247.31
    butyl lactate 215.9
    diethyl carbonate 198.16
    propanediol butyl ether 315.23
    triethyl orthoformate 164.22
    p-tert-butyltoluene 80.92
    methyl 4-tert-butylbenzoate 262.93
    morpholine 1276.55
    tert-butylamine 503.46
    n-dodecanol 63.64
    dimethoxymethane 575.7
    ethylene carbonate 580.82
    cyrene 349.93
    2-ethoxyethyl acetate 320.47
    2-ethylhexyl acetate 266.07
    1,2,4-trichlorobenzene 559.21
    4-methylpyridine 1109.45
    dibutyl ether 171.46
    2,6-dimethyl-4-heptanol 91.23
    DEF 727.06
    dimethyl isosorbide 448.98
    tetrachloroethylene 940.67
    eugenol 284.19
    triacetin 333.21
    span 80 266.74
    1,4-butanediol 316.27
    1,1-dichloroethane 946.05
    2-methyl-1-pentanol 471.41
    methyl formate 684.29
    2-methyl-1-butanol 552.99
    n-decane 15.81
    butyronitrile 687.31
    3,7-dimethyl-1-octanol 159.9
    1-chlorooctane 86.8
    1-chlorotetradecane 34.14
    n-nonane 14.78
    undecane 11.67
    tert-butylcyclohexane 34.38
    cyclooctane 13.58
    cyclopentanol 629.54
    tetrahydropyran 886.55
    tert-amyl methyl ether 410.56
    2,5,8-trioxanonane 486.53
    1-hexene 212.3
    2-isopropoxyethanol 437.83
    2,2,2-trifluoroethanol 480.83
    methyl butyrate 483.9

    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