Edulitine

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  • Identifiers

    CAS number
    15272-24-9

    Molecular formula
    C11H11NO3

    SMILES
    COC1=CC=CC2=C1NC(=O)C=C2OC

    Safety labels

  • Odor profile

    Fragrance
    Sweet 49.14%
    Fruity 39.67%
    Phenolic 37.72%
    Vanilla 35.9%
    Floral 32.32%
    Powdery 32.06%
    Spicy 29.28%
    Animal 25.98%
    Aromatic 25.37%
    Burnt 24.95%

     

    Flavor
    Bitter 81.77%
    Parsley 20.89%
    Lovage 19.84%
    Aniseed 19.66%
    Tarragon 19.55%
    Cedarleaf 19.44%
    Ethyl benzoate 19.42%
    Eugenol 19.27%
    Curry 19.12%
    Very strong 18.94%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    1.0

    pKa est.
    6.95 (neutral)

    Molecular weight
    205.21 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    407°C

    Melting point expt.

    • 235 - 236 °C

    Flash point

    • 183.54 ˚C est.

  • Synonyms

    • edulitine
    • 4,8-dimethoxy-1H-quinolin-2-one
    • Robustinin
    • 4,8-dimethoxy-2(1H)-quinolinone
    • Robustinine
    • RefChem:136315
    • 15272-24-9
    • 4,8-dimethoxy-2-quinolone
    • 4,8-Dimethoxy-2-quinolinol
    • 4,8-Dimethoxyquinolin-2(1H)-one
    • 4,8-dimethoxyquinolin-2-ol
    • Edulitin
    • 4,8-dimethoxy-1,2-dihydroquinolin-2-one
    • Oprea1_605516
    • CHEMBL256497
    • SCHEMBL3188973
    • SCHEMBL30631639
    • CHEBI:179419
    • 94P4B8V4G4
    • DTXSID901304353
    • BDBM50486606
    • 2(1H)-Quinolinone, 4,8-dimethoxy-
    • AE-562/12222659
    • 15272-24-9

  • Applications

    Edulitine, CAS 15272-24-9, is regarded as an organic chemical intermediate with potential uses as a solvent or reagent in various industrial processes; it may serve as a precursor in the manufacture of polymers and plastics; it has been evaluated for applications in coatings/inks and adhesives as a processing aid or additive to modify properties; it may also be considered for cleaning formulations and other industrial formulations, depending on regulatory constraints and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 2.99
    methanol 3.88
    isopropanol 2.08
    water 0.1
    ethyl acetate 5.04
    n-propanol 2.6
    acetone 6.36
    n-butanol 2.57
    acetonitrile 5.8
    DMF 33.38
    toluene 0.67
    isobutanol 2.51
    1,4-dioxane 9.88
    methyl acetate 7.57
    THF 23.68
    2-butanone 5.92
    n-pentanol 2.83
    sec-butanol 1.78
    n-hexane 0.08
    ethylene glycol 3.61
    NMP 33.05
    cyclohexane 0.15
    DMSO 50.4
    n-butyl acetate 6.12
    n-octanol 2.27
    chloroform 7.19
    n-propyl acetate 6.51
    acetic acid 11.02
    dichloromethane 15.28
    cyclohexanone 15.58
    propylene glycol 1.05
    isopropyl acetate 3.28
    DMAc 42.32
    2-ethoxyethanol 10.65
    isopentanol 3.42
    n-heptane 0.25
    ethyl formate 7.36
    1,2-dichloroethane 12.2
    n-hexanol 3.65
    2-methoxyethanol 18.19
    isobutyl acetate 4.58
    tetrachloromethane 1.32
    n-pentyl acetate 4.28
    transcutol 14.04
    n-heptanol 2.97
    ethylbenzene 1.34
    MIBK 3.94
    2-propoxyethanol 13.77
    tert-butanol 4.17
    MTBE 1.83
    2-butoxyethanol 8.85
    propionic acid 4.88
    o-xylene 1.56
    formic acid 9.35
    diethyl ether 1.49
    m-xylene 1.19
    p-xylene 2.47
    chlorobenzene 3.2
    dimethyl carbonate 6.26
    n-octane 0.16
    formamide 17.88
    cyclopentanone 21.19
    2-pentanone 4.19
    anisole 4.58
    cyclopentyl methyl ether 6.29
    gamma-butyrolactone 32.72
    1-methoxy-2-propanol 7.86
    pyridine 10.66
    3-pentanone 4.24
    furfural 33.4
    n-dodecane 0.2
    diethylene glycol 16.83
    diisopropyl ether 0.62
    tert-amyl alcohol 3.04
    acetylacetone 8.47
    n-hexadecane 0.24
    acetophenone 8.68
    methyl propionate 6.57
    isopentyl acetate 6.81
    trichloroethylene 21.39
    n-nonanol 2.61
    cyclohexanol 3.44
    benzyl alcohol 6.25
    2-ethylhexanol 3.63
    isooctanol 3.07
    dipropyl ether 2.83
    1,2-dichlorobenzene 5.31
    ethyl lactate 5.39
    propylene carbonate 13.96
    n-methylformamide 14.02
    2-pentanol 1.43
    n-pentane 0.07
    1-propoxy-2-propanol 7.3
    1-methoxy-2-propyl acetate 8.52
    2-(2-methoxypropoxy) propanol 9.91
    mesitylene 0.98
    ε-caprolactone 14.75
    p-cymene 2.42
    epichlorohydrin 34.63
    1,1,1-trichloroethane 5.85
    2-aminoethanol 3.72
    morpholine-4-carbaldehyde 31.36
    sulfolane 38.37
    2,2,4-trimethylpentane 0.12
    2-methyltetrahydrofuran 10.92
    n-hexyl acetate 4.99
    isooctane 0.08
    2-(2-butoxyethoxy)ethanol 10.16
    sec-butyl acetate 3.83
    tert-butyl acetate 4.39
    decalin 0.28
    glycerin 5.45
    diglyme 22.71
    acrylic acid 6.54
    isopropyl myristate 2.67
    n-butyric acid 6.49
    acetyl acetate 4.53
    di(2-ethylhexyl) phthalate 4.88
    ethyl propionate 5.93
    nitromethane 25.95
    1,2-diethoxyethane 5.18
    benzonitrile 7.99
    trioctyl phosphate 3.29
    1-bromopropane 2.66
    gamma-valerolactone 30.86
    n-decanol 2.16
    triethyl phosphate 6.79
    4-methyl-2-pentanol 1.54
    propionitrile 5.57
    vinylene carbonate 14.87
    1,1,2-trichlorotrifluoroethane 25.26
    DMS 7.87
    cumene 1.7
    2-octanol 1.75
    2-hexanone 5.99
    octyl acetate 3.55
    limonene 2.63
    1,2-dimethoxyethane 23.04
    ethyl orthosilicate 6.14
    tributyl phosphate 3.92
    diacetone alcohol 8.11
    N,N-dimethylaniline 5.21
    acrylonitrile 9.61
    aniline 3.44
    1,3-propanediol 6.95
    bromobenzene 2.47
    dibromomethane 6.03
    1,1,2,2-tetrachloroethane 14.02
    2-methyl-cyclohexyl acetate 7.84
    tetrabutyl urea 6.33
    diisobutyl methanol 2.34
    2-phenylethanol 7.52
    styrene 1.14
    dioctyl adipate 5.2
    dimethyl sulfate 16.15
    ethyl butyrate 6.11
    methyl lactate 5.6
    butyl lactate 4.51
    diethyl carbonate 6.05
    propanediol butyl ether 4.61
    triethyl orthoformate 6.04
    p-tert-butyltoluene 1.96
    methyl 4-tert-butylbenzoate 9.5
    morpholine 12.69
    tert-butylamine 1.81
    n-dodecanol 1.78
    dimethoxymethane 14.75
    ethylene carbonate 11.44
    cyrene 15.33
    2-ethoxyethyl acetate 7.85
    2-ethylhexyl acetate 5.63
    1,2,4-trichlorobenzene 7.23
    4-methylpyridine 8.69
    dibutyl ether 2.44
    2,6-dimethyl-4-heptanol 2.34
    DEF 10.73
    dimethyl isosorbide 20.37
    tetrachloroethylene 10.4
    eugenol 10.45
    triacetin 7.58
    span 80 6.25
    1,4-butanediol 3.0
    1,1-dichloroethane 4.51
    2-methyl-1-pentanol 3.83
    methyl formate 13.77
    2-methyl-1-butanol 2.86
    n-decane 0.29
    butyronitrile 5.13
    3,7-dimethyl-1-octanol 2.69
    1-chlorooctane 1.39
    1-chlorotetradecane 0.76
    n-nonane 0.22
    undecane 0.24
    tert-butylcyclohexane 0.26
    cyclooctane 0.08
    cyclopentanol 5.05
    tetrahydropyran 5.64
    tert-amyl methyl ether 1.98
    2,5,8-trioxanonane 17.67
    1-hexene 0.5
    2-isopropoxyethanol 7.6
    2,2,2-trifluoroethanol 9.94
    methyl butyrate 8.83

    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