(Z)-3-Phenylpropyl 3-phenylacrylate

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  • Identifiers

    Molecular formula
    C18H18O2

    SMILES
    C1=CC=C(C=C1)CCCOC(=O)/C=C\C2=CC=CC=C2

  • Odor profile

    Balsamic 90.96%
    Sweet 86.89%
    Spicy 74.97%
    Cinnamon 65.89%
    Fruity 65.0%
    Floral 60.34%
    Rose 55.48%
    Honey 54.01%
    Cocoa 41.02%
    Powdery 35.06%

    Scent© AI

  • Properties

    XLogP3-AA
    4.9

    Molecular weight
    266.3 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    387°C

    Flash point est.
    197.24 ˚C

  • Synonyms

    • (Z) Phenylpropyl cinnamate
    • SCHEMBL1532425
    • LYRAHIUDQRJGGZ-YPKPFQOOSA-N
    • (Z)-3-Phenylpropyl 3-phenylacrylate

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 73.86
    methanol 112.24
    isopropanol 27.58
    water 0.08
    ethyl acetate 257.08
    n-propanol 54.79
    acetone 282.9
    n-butanol 45.07
    acetonitrile 162.38
    DMF 475.58
    toluene 136.94
    isobutanol 30.1
    1,4-dioxane 295.24
    methyl acetate 221.95
    THF 528.07
    2-butanone 251.89
    n-pentanol 44.04
    sec-butanol 37.19
    n-hexane 3.82
    ethylene glycol 15.18
    NMP 273.85
    cyclohexane 4.86
    DMSO 636.23
    n-butyl acetate 132.07
    n-octanol 13.34
    chloroform 953.8
    n-propyl acetate 146.74
    acetic acid 103.23
    dichloromethane 1386.75
    cyclohexanone 278.89
    propylene glycol 26.41
    isopropyl acetate 131.9
    DMAc 607.43
    2-ethoxyethanol 128.05
    isopentanol 42.56
    n-heptane 3.53
    ethyl formate 96.95
    1,2-dichloroethane 1094.0
    n-hexanol 38.24
    2-methoxyethanol 165.93
    isobutyl acetate 85.82
    tetrachloromethane 35.1
    n-pentyl acetate 54.4
    transcutol 863.64
    n-heptanol 17.39
    ethylbenzene 60.17
    MIBK 108.96
    2-propoxyethanol 117.66
    tert-butanol 37.2
    MTBE 82.74
    2-butoxyethanol 62.21
    propionic acid 83.6
    o-xylene 60.45
    formic acid 41.39
    diethyl ether 155.52
    m-xylene 59.03
    p-xylene 61.44
    chlorobenzene 240.14
    dimethyl carbonate 151.21
    n-octane 1.54
    formamide 133.47
    cyclopentanone 422.09
    2-pentanone 188.66
    anisole 193.08
    cyclopentyl methyl ether 158.06
    gamma-butyrolactone 487.63
    1-methoxy-2-propanol 120.29
    pyridine 430.55
    3-pentanone 183.3
    furfural 366.67
    n-dodecane 1.65
    diethylene glycol 85.5
    diisopropyl ether 30.66
    tert-amyl alcohol 41.89
    acetylacetone 325.32
    n-hexadecane 1.96
    acetophenone 172.33
    methyl propionate 235.97
    isopentyl acetate 115.31
    trichloroethylene 1523.53
    n-nonanol 15.43
    cyclohexanol 41.61
    benzyl alcohol 98.44
    2-ethylhexanol 29.93
    isooctanol 17.43
    dipropyl ether 73.56
    1,2-dichlorobenzene 232.2
    ethyl lactate 55.72
    propylene carbonate 209.23
    n-methylformamide 169.99
    2-pentanol 29.55
    n-pentane 2.12
    1-propoxy-2-propanol 80.68
    1-methoxy-2-propyl acetate 170.0
    2-(2-methoxypropoxy) propanol 102.85
    mesitylene 31.32
    ε-caprolactone 211.66
    p-cymene 27.88
    epichlorohydrin 898.59
    1,1,1-trichloroethane 361.5
    2-aminoethanol 37.75
    morpholine-4-carbaldehyde 286.35
    sulfolane 527.94
    2,2,4-trimethylpentane 3.89
    2-methyltetrahydrofuran 211.77
    n-hexyl acetate 68.99
    isooctane 2.72
    2-(2-butoxyethoxy)ethanol 139.97
    sec-butyl acetate 101.18
    tert-butyl acetate 133.86
    decalin 8.41
    glycerin 42.91
    diglyme 349.24
    acrylic acid 87.42
    isopropyl myristate 30.81
    n-butyric acid 109.24
    acetyl acetate 160.67
    di(2-ethylhexyl) phthalate 35.7
    ethyl propionate 140.0
    nitromethane 423.77
    1,2-diethoxyethane 224.75
    benzonitrile 136.79
    trioctyl phosphate 19.44
    1-bromopropane 261.87
    gamma-valerolactone 424.86
    n-decanol 12.34
    triethyl phosphate 62.28
    4-methyl-2-pentanol 22.44
    propionitrile 116.22
    vinylene carbonate 193.95
    1,1,2-trichlorotrifluoroethane 319.51
    DMS 134.53
    cumene 34.02
    2-octanol 9.85
    2-hexanone 131.39
    octyl acetate 36.13
    limonene 36.9
    1,2-dimethoxyethane 264.64
    ethyl orthosilicate 57.22
    tributyl phosphate 31.81
    diacetone alcohol 121.62
    N,N-dimethylaniline 98.49
    acrylonitrile 184.36
    aniline 131.05
    1,3-propanediol 50.6
    bromobenzene 280.95
    dibromomethane 641.11
    1,1,2,2-tetrachloroethane 1088.4
    2-methyl-cyclohexyl acetate 82.79
    tetrabutyl urea 45.1
    diisobutyl methanol 22.93
    2-phenylethanol 75.63
    styrene 98.9
    dioctyl adipate 62.62
    dimethyl sulfate 248.58
    ethyl butyrate 116.67
    methyl lactate 79.71
    butyl lactate 49.39
    diethyl carbonate 89.31
    propanediol butyl ether 51.73
    triethyl orthoformate 81.01
    p-tert-butyltoluene 25.62
    methyl 4-tert-butylbenzoate 96.92
    morpholine 291.98
    tert-butylamine 21.93
    n-dodecanol 9.97
    dimethoxymethane 356.45
    ethylene carbonate 147.97
    cyrene 96.21
    2-ethoxyethyl acetate 129.66
    2-ethylhexyl acetate 90.07
    1,2,4-trichlorobenzene 267.68
    4-methylpyridine 303.3
    dibutyl ether 48.79
    2,6-dimethyl-4-heptanol 22.93
    DEF 245.29
    dimethyl isosorbide 216.48
    tetrachloroethylene 503.19
    eugenol 91.75
    triacetin 122.45
    span 80 63.48
    1,4-butanediol 23.6
    1,1-dichloroethane 512.41
    2-methyl-1-pentanol 47.81
    methyl formate 132.47
    2-methyl-1-butanol 42.36
    n-decane 2.46
    butyronitrile 96.15
    3,7-dimethyl-1-octanol 22.52
    1-chlorooctane 16.53
    1-chlorotetradecane 7.9
    n-nonane 2.04
    undecane 1.94
    tert-butylcyclohexane 7.02
    cyclooctane 1.93
    cyclopentanol 42.06
    tetrahydropyran 207.53
    tert-amyl methyl ether 72.16
    2,5,8-trioxanonane 223.7
    1-hexene 30.54
    2-isopropoxyethanol 87.26
    2,2,2-trifluoroethanol 41.94
    methyl butyrate 173.42

    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