4-Allyl-2-methoxyphenyl cinnamate

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  • Identifiers

    CAS number
    532-08-1

    Molecular formula
    C19H18O3

    SMILES
    COC1=C(C=CC(=C1)CC=C)OC(=O)/C=C/C2=CC=CC=C2

    Safety labels

    Irritant
    Irritant

    Environmental Hazard
    Environmental

  • Odor profile

    Spicy 71.63%
    Balsamic 69.1%
    Sweet 57.75%
    Cinnamon 51.11%
    Warm 43.93%
    Clove 43.46%
    Floral 40.46%
    Honey 35.33%
    Vanilla 32.7%
    Powdery 32.64%

    Scent© AI

  • Properties

    XLogP3-AA
    4.8

    pKa est.
    6.79 (neutral)

    Molecular weight
    294.3 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    424°C

    Flash point est.
    181.95 ˚C

  • Synonyms

    • 4-Allyl-2-methoxyphenyl cinnamate
    • 532-08-1
    • EINECS 208-526-4
    • Cinnamyl eugenol
    • NSC 46764
    • Cinnamyleugenol
    • eugenyl cinnamate
    • Cinnamic acid, ester with eugenol
    • SCHEMBL4201037
    • CHEMBL2271265
    • SJKFNIODBSUYID-ACCUITESSA-N
    • NSC46764
    • NSC-46764
    • AKOS024336571
    • NS00042968
    • Cinnamic acid, 4-allyl-2-methoxyphenyl ester
    • Q61082202
    • (4-allyl-2-methoxy-phenyl) (E)-3-phenylprop-2-enoate
    • 2-Propenoic acid, 2-methoxy-4-(2-propenyl)phenyl ester
    • 208-526-4

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 120.23
    methanol 147.07
    isopropanol 52.2
    water 0.03
    ethyl acetate 448.99
    n-propanol 94.57
    acetone 457.03
    n-butanol 71.34
    acetonitrile 271.31
    DMF 453.56
    toluene 274.3
    isobutanol 52.11
    1,4-dioxane 275.23
    methyl acetate 375.43
    THF 893.76
    2-butanone 414.08
    n-pentanol 58.93
    sec-butanol 73.19
    n-hexane 5.01
    ethylene glycol 21.19
    NMP 319.82
    cyclohexane 13.01
    DMSO 738.76
    n-butyl acetate 131.47
    n-octanol 17.62
    chloroform 1273.85
    n-propyl acetate 148.37
    acetic acid 160.15
    dichloromethane 1904.81
    cyclohexanone 406.11
    propylene glycol 38.15
    isopropyl acetate 178.26
    DMAc 605.38
    2-ethoxyethanol 141.48
    isopentanol 61.29
    n-heptane 4.71
    ethyl formate 126.85
    1,2-dichloroethane 1386.89
    n-hexanol 47.04
    2-methoxyethanol 235.53
    isobutyl acetate 83.83
    tetrachloromethane 52.33
    n-pentyl acetate 60.49
    transcutol 507.57
    n-heptanol 21.88
    ethylbenzene 70.32
    MIBK 137.37
    2-propoxyethanol 128.74
    tert-butanol 74.69
    MTBE 121.89
    2-butoxyethanol 65.09
    propionic acid 123.82
    o-xylene 83.34
    formic acid 48.39
    diethyl ether 231.92
    m-xylene 89.18
    p-xylene 75.24
    chlorobenzene 313.83
    dimethyl carbonate 212.4
    n-octane 2.64
    formamide 161.52
    cyclopentanone 679.78
    2-pentanone 284.27
    anisole 183.3
    cyclopentyl methyl ether 265.78
    gamma-butyrolactone 645.03
    1-methoxy-2-propanol 165.21
    pyridine 525.11
    3-pentanone 293.11
    furfural 403.78
    n-dodecane 2.79
    diethylene glycol 95.71
    diisopropyl ether 40.6
    tert-amyl alcohol 77.45
    acetylacetone 375.36
    n-hexadecane 3.28
    acetophenone 176.44
    methyl propionate 380.47
    isopentyl acetate 115.39
    trichloroethylene 1869.98
    n-nonanol 19.71
    cyclohexanol 83.78
    benzyl alcohol 118.36
    2-ethylhexanol 34.81
    isooctanol 22.05
    dipropyl ether 66.02
    1,2-dichlorobenzene 249.76
    ethyl lactate 60.78
    propylene carbonate 254.24
    n-methylformamide 211.4
    2-pentanol 51.64
    n-pentane 4.31
    1-propoxy-2-propanol 83.31
    1-methoxy-2-propyl acetate 169.84
    2-(2-methoxypropoxy) propanol 90.83
    mesitylene 40.05
    ε-caprolactone 277.89
    p-cymene 30.69
    epichlorohydrin 1185.98
    1,1,1-trichloroethane 514.21
    2-aminoethanol 51.38
    morpholine-4-carbaldehyde 276.92
    sulfolane 626.15
    2,2,4-trimethylpentane 5.78
    2-methyltetrahydrofuran 372.05
    n-hexyl acetate 74.48
    isooctane 3.81
    2-(2-butoxyethoxy)ethanol 114.44
    sec-butyl acetate 107.16
    tert-butyl acetate 163.43
    decalin 10.49
    glycerin 52.85
    diglyme 267.48
    acrylic acid 118.79
    isopropyl myristate 35.99
    n-butyric acid 150.45
    acetyl acetate 223.24
    di(2-ethylhexyl) phthalate 38.98
    ethyl propionate 156.1
    nitromethane 542.72
    1,2-diethoxyethane 165.8
    benzonitrile 152.69
    trioctyl phosphate 23.54
    1-bromopropane 415.78
    gamma-valerolactone 487.0
    n-decanol 16.26
    triethyl phosphate 58.53
    4-methyl-2-pentanol 31.56
    propionitrile 183.8
    vinylene carbonate 210.61
    1,1,2-trichlorotrifluoroethane 346.23
    DMS 148.44
    cumene 36.63
    2-octanol 14.68
    2-hexanone 136.74
    octyl acetate 42.37
    limonene 42.58
    1,2-dimethoxyethane 261.92
    ethyl orthosilicate 53.89
    tributyl phosphate 33.46
    diacetone alcohol 152.09
    N,N-dimethylaniline 88.55
    acrylonitrile 276.76
    aniline 200.54
    1,3-propanediol 73.51
    bromobenzene 374.84
    dibromomethane 1003.11
    1,1,2,2-tetrachloroethane 1254.01
    2-methyl-cyclohexyl acetate 78.56
    tetrabutyl urea 47.42
    diisobutyl methanol 26.65
    2-phenylethanol 92.19
    styrene 112.59
    dioctyl adipate 64.29
    dimethyl sulfate 287.7
    ethyl butyrate 108.95
    methyl lactate 109.87
    butyl lactate 48.89
    diethyl carbonate 84.12
    propanediol butyl ether 47.13
    triethyl orthoformate 71.99
    p-tert-butyltoluene 29.36
    methyl 4-tert-butylbenzoate 91.5
    morpholine 337.38
    tert-butylamine 37.7
    n-dodecanol 13.78
    dimethoxymethane 445.42
    ethylene carbonate 170.34
    cyrene 97.52
    2-ethoxyethyl acetate 124.96
    2-ethylhexyl acetate 88.16
    1,2,4-trichlorobenzene 297.32
    4-methylpyridine 398.92
    dibutyl ether 48.11
    2,6-dimethyl-4-heptanol 26.65
    DEF 287.52
    dimethyl isosorbide 198.71
    tetrachloroethylene 579.29
    eugenol 85.18
    triacetin 109.62
    span 80 57.05
    1,4-butanediol 28.6
    1,1-dichloroethane 759.84
    2-methyl-1-pentanol 63.31
    methyl formate 189.25
    2-methyl-1-butanol 64.06
    n-decane 3.95
    butyronitrile 134.06
    3,7-dimethyl-1-octanol 27.75
    1-chlorooctane 22.51
    1-chlorotetradecane 11.01
    n-nonane 3.35
    undecane 3.25
    tert-butylcyclohexane 8.23
    cyclooctane 4.12
    cyclopentanol 92.5
    tetrahydropyran 325.66
    tert-amyl methyl ether 106.65
    2,5,8-trioxanonane 191.59
    1-hexene 35.06
    2-isopropoxyethanol 94.43
    2,2,2-trifluoroethanol 56.31
    methyl butyrate 177.91

    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