(Z)-4-(3-hydroxyanilino)-4-oxobut-2-enoate

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  • Identifiers

    Molecular formula
    C10H8NO4-

    SMILES
    C1=CC(=CC(=C1)O)NC(=O)/C=C\C(=O)[O-]

  • Odor profile

    Odorless 49.52%
    Fruity 37.86%
    Savory 31.58%
    Burnt 27.52%
    Cooked 26.9%
    Meaty 26.85%
    Sweet 23.29%
    Bitter 22.87%
    Roasted 22.2%
    Grape 20.34%

    Scent© AI

  • Properties

    XLogP3-AA
    1.1

    Molecular weight
    206.17 g/mol

    Flash point est.
    206.71 ˚C

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 9.36
    methanol 20.48
    isopropanol 4.35
    water 0.59
    ethyl acetate 2.3
    n-propanol 6.1
    acetone 8.13
    n-butanol 3.91
    acetonitrile 3.09
    DMF 100.02
    toluene 0.04
    isobutanol 2.35
    1,4-dioxane 5.27
    methyl acetate 6.92
    THF 26.16
    2-butanone 9.52
    n-pentanol 2.89
    sec-butanol 5.15
    n-hexane 0.01
    ethylene glycol 11.64
    NMP 59.4
    cyclohexane 0.0
    DMSO 211.12
    n-butyl acetate 3.15
    n-octanol 1.0
    chloroform 0.04
    n-propyl acetate 3.42
    acetic acid 11.65
    dichloromethane 0.06
    cyclohexanone 3.91
    propylene glycol 12.94
    isopropyl acetate 1.77
    DMAc 176.51
    2-ethoxyethanol 39.55
    isopentanol 3.88
    n-heptane 0.02
    ethyl formate 4.36
    1,2-dichloroethane 0.13
    n-hexanol 1.48
    2-methoxyethanol 74.14
    isobutyl acetate 1.24
    tetrachloromethane 0.03
    n-pentyl acetate 1.16
    transcutol 78.85
    n-heptanol 1.05
    ethylbenzene 0.12
    MIBK 2.63
    2-propoxyethanol 23.63
    tert-butanol 7.28
    MTBE 2.25
    2-butoxyethanol 9.24
    propionic acid 7.49
    o-xylene 0.14
    formic acid 25.08
    diethyl ether 0.94
    m-xylene 0.08
    p-xylene 0.17
    chlorobenzene 0.06
    dimethyl carbonate 5.22
    n-octane 0.01
    formamide 63.93
    cyclopentanone 10.71
    2-pentanone 3.04
    anisole 3.16
    cyclopentyl methyl ether 1.52
    gamma-butyrolactone 17.42
    1-methoxy-2-propanol 35.85
    pyridine 1.83
    3-pentanone 1.94
    furfural 17.79
    n-dodecane 0.02
    diethylene glycol 36.92
    diisopropyl ether 0.25
    tert-amyl alcohol 7.82
    acetylacetone 6.57
    n-hexadecane 0.02
    acetophenone 4.73
    methyl propionate 4.68
    isopentyl acetate 3.33
    trichloroethylene 0.29
    n-nonanol 1.03
    cyclohexanol 1.08
    benzyl alcohol 3.42
    2-ethylhexanol 1.01
    isooctanol 0.95
    dipropyl ether 1.23
    1,2-dichlorobenzene 0.18
    ethyl lactate 7.74
    propylene carbonate 6.8
    n-methylformamide 34.01
    2-pentanol 1.55
    n-pentane 0.01
    1-propoxy-2-propanol 13.71
    1-methoxy-2-propyl acetate 8.92
    2-(2-methoxypropoxy) propanol 23.15
    mesitylene 0.1
    ε-caprolactone 6.55
    p-cymene 0.29
    epichlorohydrin 11.26
    1,1,1-trichloroethane 0.09
    2-aminoethanol 19.04
    morpholine-4-carbaldehyde 44.29
    sulfolane 43.08
    2,2,4-trimethylpentane 0.02
    2-methyltetrahydrofuran 5.28
    n-hexyl acetate 2.05
    isooctane 0.01
    2-(2-butoxyethoxy)ethanol 22.81
    sec-butyl acetate 1.9
    tert-butyl acetate 3.39
    decalin 0.02
    glycerin 31.26
    diglyme 41.66
    acrylic acid 8.68
    isopropyl myristate 1.02
    n-butyric acid 4.96
    acetyl acetate 1.84
    di(2-ethylhexyl) phthalate 2.93
    ethyl propionate 3.62
    nitromethane 34.31
    1,2-diethoxyethane 5.85
    benzonitrile 1.4
    trioctyl phosphate 1.5
    1-bromopropane 0.07
    gamma-valerolactone 24.55
    n-decanol 0.79
    triethyl phosphate 3.98
    4-methyl-2-pentanol 1.18
    propionitrile 2.44
    vinylene carbonate 4.96
    1,1,2-trichlorotrifluoroethane 17.92
    DMS 4.58
    cumene 0.17
    2-octanol 0.55
    2-hexanone 4.01
    octyl acetate 1.42
    limonene 0.33
    1,2-dimethoxyethane 46.51
    ethyl orthosilicate 3.13
    tributyl phosphate 2.36
    diacetone alcohol 13.86
    N,N-dimethylaniline 2.75
    acrylonitrile 4.3
    aniline 0.6
    1,3-propanediol 21.34
    bromobenzene 0.04
    dibromomethane 0.03
    1,1,2,2-tetrachloroethane 0.39
    2-methyl-cyclohexyl acetate 3.52
    tetrabutyl urea 4.53
    diisobutyl methanol 0.8
    2-phenylethanol 2.92
    styrene 0.12
    dioctyl adipate 3.3
    dimethyl sulfate 19.0
    ethyl butyrate 3.61
    methyl lactate 13.65
    butyl lactate 4.44
    diethyl carbonate 3.45
    propanediol butyl ether 12.32
    triethyl orthoformate 3.98
    p-tert-butyltoluene 0.27
    methyl 4-tert-butylbenzoate 7.11
    morpholine 13.92
    tert-butylamine 1.28
    n-dodecanol 0.57
    dimethoxymethane 24.63
    ethylene carbonate 3.38
    cyrene 21.42
    2-ethoxyethyl acetate 3.77
    2-ethylhexyl acetate 2.13
    1,2,4-trichlorobenzene 0.38
    4-methylpyridine 1.54
    dibutyl ether 1.09
    2,6-dimethyl-4-heptanol 0.8
    DEF 11.1
    dimethyl isosorbide 30.99
    tetrachloroethylene 0.22
    eugenol 9.61
    triacetin 6.58
    span 80 9.17
    1,4-butanediol 8.21
    1,1-dichloroethane 0.05
    2-methyl-1-pentanol 3.18
    methyl formate 16.3
    2-methyl-1-butanol 3.89
    n-decane 0.02
    butyronitrile 1.83
    3,7-dimethyl-1-octanol 1.24
    1-chlorooctane 0.13
    1-chlorotetradecane 0.08
    n-nonane 0.02
    undecane 0.02
    tert-butylcyclohexane 0.02
    cyclooctane 0.0
    cyclopentanol 2.08
    tetrahydropyran 1.19
    tert-amyl methyl ether 2.68
    2,5,8-trioxanonane 35.92
    1-hexene 0.08
    2-isopropoxyethanol 16.38
    2,2,2-trifluoroethanol 6.38
    methyl butyrate 5.73

    Scent© AI

1 3

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