Allyl decanoate

Overview IFRA Botanical Request a quote

  • Identifiers

    CAS number
    57856-81-2

    Molecular formula
    C13H24O2

    SMILES
    CCCCCCCCCC(=O)OCC=C

    Safety labels

    Acute Toxic
    Acute Toxic

    Retention indicies (RI)

    • DB5: 1476.5
    • Carbowax: 1752.0

  • Odor profile

    Fruity 91.67%
    Fatty 73.87%
    Sweet 68.01%
    Waxy 67.14%
    Winey 63.65%
    Pineapple 61.82%
    Oily 53.07%
    Cognac 50.78%
    Peach 44.55%
    Apricot 43.37%

    Scent© AI

  • Properties

    XLogP3-AA
    4.8

    Molecular weight
    212.33 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Very slow

    Boiling point est.
    264°C

    Flash point est.
    110.26 ˚C

  • Synonyms

    • Allyl decanoate
    • Allyl caprate
    • 57856-81-2
    • prop-2-enyl decanoate
    • Decanoic acid, 2-propenyl ester
    • EINECS 260-992-8
    • Decanoic acid, 2-propen-1-yl ester
    • DTXSID5069209
    • Allyl n-decanoate
    • Allyl-Decanoat
    • Allyl n-caprate
    • AllOCONon
    • Allyl decanoate #
    • SCHEMBL436741
    • CHEMBL2229587
    • DTXCID2042276
    • NS00033802
    • Q63392699
    • 260-992-8

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2369.54
    methanol 2184.23
    isopropanol 2274.85
    water 0.02
    ethyl acetate 3661.12
    n-propanol 2122.59
    acetone 4758.23
    n-butanol 1971.39
    acetonitrile 2049.9
    DMF 2850.56
    toluene 1227.57
    isobutanol 1697.88
    1,4-dioxane 2635.6
    methyl acetate 2236.38
    THF 4848.31
    2-butanone 3851.14
    n-pentanol 1576.5
    sec-butanol 2204.75
    n-hexane 812.16
    ethylene glycol 90.69
    NMP 2150.5
    cyclohexane 1007.82
    DMSO 3537.44
    n-butyl acetate 3336.5
    n-octanol 649.97
    chloroform 3929.06
    n-propyl acetate 2818.73
    acetic acid 1159.59
    dichloromethane 4427.59
    cyclohexanone 5132.34
    propylene glycol 255.09
    isopropyl acetate 2427.75
    DMAc 2195.12
    2-ethoxyethanol 1371.25
    isopentanol 1990.96
    n-heptane 305.47
    ethyl formate 1314.05
    1,2-dichloroethane 3517.22
    n-hexanol 1554.16
    2-methoxyethanol 1890.81
    isobutyl acetate 1498.11
    tetrachloromethane 631.13
    n-pentyl acetate 1708.97
    transcutol 5001.07
    n-heptanol 578.87
    ethylbenzene 768.41
    MIBK 1836.19
    2-propoxyethanol 1886.3
    tert-butanol 2579.45
    MTBE 3492.21
    2-butoxyethanol 999.21
    propionic acid 1109.23
    o-xylene 730.05
    formic acid 152.14
    diethyl ether 3828.19
    m-xylene 819.81
    p-xylene 941.25
    chlorobenzene 1594.26
    dimethyl carbonate 406.31
    n-octane 109.9
    formamide 298.21
    cyclopentanone 3971.62
    2-pentanone 3753.7
    anisole 1137.83
    cyclopentyl methyl ether 2920.17
    gamma-butyrolactone 3151.58
    1-methoxy-2-propanol 1731.64
    pyridine 2896.4
    3-pentanone 2153.76
    furfural 2071.93
    n-dodecane 60.82
    diethylene glycol 715.54
    diisopropyl ether 1039.91
    tert-amyl alcohol 2328.61
    acetylacetone 2595.47
    n-hexadecane 73.76
    acetophenone 1144.14
    methyl propionate 1907.91
    isopentyl acetate 2575.63
    trichloroethylene 5064.49
    n-nonanol 549.26
    cyclohexanol 2106.07
    benzyl alcohol 813.06
    2-ethylhexanol 1126.2
    isooctanol 539.77
    dipropyl ether 1880.28
    1,2-dichlorobenzene 1371.31
    ethyl lactate 557.59
    propylene carbonate 1724.6
    n-methylformamide 1061.68
    2-pentanol 1840.04
    n-pentane 434.78
    1-propoxy-2-propanol 1717.5
    1-methoxy-2-propyl acetate 1847.03
    2-(2-methoxypropoxy) propanol 903.14
    mesitylene 528.07
    ε-caprolactone 3315.09
    p-cymene 427.46
    epichlorohydrin 3790.49
    1,1,1-trichloroethane 3192.1
    2-aminoethanol 372.23
    morpholine-4-carbaldehyde 1883.1
    sulfolane 3124.5
    2,2,4-trimethylpentane 178.77
    2-methyltetrahydrofuran 4396.86
    n-hexyl acetate 1919.77
    isooctane 150.42
    2-(2-butoxyethoxy)ethanol 1281.23
    sec-butyl acetate 1791.19
    tert-butyl acetate 2161.14
    decalin 329.89
    glycerin 257.51
    diglyme 2432.54
    acrylic acid 623.45
    isopropyl myristate 580.41
    n-butyric acid 2578.5
    acetyl acetate 1417.51
    di(2-ethylhexyl) phthalate 421.86
    ethyl propionate 2030.3
    nitromethane 2229.23
    1,2-diethoxyethane 2668.04
    benzonitrile 1368.56
    trioctyl phosphate 318.42
    1-bromopropane 2999.07
    gamma-valerolactone 3710.98
    n-decanol 366.2
    triethyl phosphate 536.58
    4-methyl-2-pentanol 890.39
    propionitrile 1847.82
    vinylene carbonate 1305.36
    1,1,2-trichlorotrifluoroethane 1691.66
    DMS 983.9
    cumene 458.82
    2-octanol 513.66
    2-hexanone 2779.95
    octyl acetate 690.59
    limonene 833.11
    1,2-dimethoxyethane 3058.58
    ethyl orthosilicate 548.19
    tributyl phosphate 468.39
    diacetone alcohol 1638.52
    N,N-dimethylaniline 731.27
    acrylonitrile 1658.74
    aniline 1116.7
    1,3-propanediol 761.43
    bromobenzene 1902.45
    dibromomethane 3430.67
    1,1,2,2-tetrachloroethane 4184.1
    2-methyl-cyclohexyl acetate 1110.33
    tetrabutyl urea 596.13
    diisobutyl methanol 613.03
    2-phenylethanol 856.25
    styrene 1034.92
    dioctyl adipate 785.76
    dimethyl sulfate 626.04
    ethyl butyrate 1931.21
    methyl lactate 496.82
    butyl lactate 945.88
    diethyl carbonate 957.53
    propanediol butyl ether 797.49
    triethyl orthoformate 1003.54
    p-tert-butyltoluene 400.9
    methyl 4-tert-butylbenzoate 795.06
    morpholine 3790.0
    tert-butylamine 1665.16
    n-dodecanol 268.87
    dimethoxymethane 1784.45
    ethylene carbonate 1256.89
    cyrene 662.71
    2-ethoxyethyl acetate 1637.39
    2-ethylhexyl acetate 1961.71
    1,2,4-trichlorobenzene 1456.17
    4-methylpyridine 3059.84
    dibutyl ether 1794.81
    2,6-dimethyl-4-heptanol 613.03
    DEF 3002.2
    dimethyl isosorbide 1456.8
    tetrachloroethylene 2521.46
    eugenol 723.6
    triacetin 1181.39
    span 80 874.59
    1,4-butanediol 321.22
    1,1-dichloroethane 3770.08
    2-methyl-1-pentanol 1442.86
    methyl formate 651.99
    2-methyl-1-butanol 1704.07
    n-decane 133.47
    butyronitrile 2511.94
    3,7-dimethyl-1-octanol 755.78
    1-chlorooctane 642.94
    1-chlorotetradecane 190.24
    n-nonane 145.38
    undecane 84.79
    tert-butylcyclohexane 285.45
    cyclooctane 247.02
    cyclopentanol 1772.19
    tetrahydropyran 5331.99
    tert-amyl methyl ether 2183.29
    2,5,8-trioxanonane 1437.7
    1-hexene 2533.4
    2-isopropoxyethanol 1188.35
    2,2,2-trifluoroethanol 223.66
    methyl butyrate 2949.53

    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

Botanical

Name CAS Botanical Proportion
Aristolochia brevipes Aristolochia brevipes Benth., fam. Aristolochiaceae 0.2%