Butanamide, 2-ethyl-N-methyl-N-(3-methylphenyl)-

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  • Identifiers

    CAS number
    406488-30-0

    Molecular formula
    C14H21NO

    SMILES
    CCC(CC)C(=O)N(C)C1=CC=CC(=C1)C

    Safety labels

    Irritant
    Irritant

    Environmental Hazard
    Environmental

  • Odor profile

    Fragrance
    Grapefruit 46.26%
    Woody 45.8%
    Mint 37.93%
    Citrus 37.57%
    Cooling 34.04%
    Fresh 33.21%
    Herbal 31.93%
    Floral 31.34%
    Animal 28.92%
    Tropical 28.1%

     

    Flavor
    Herbal 30.44%
    Fruity 30.32%
    Bitter 25.31%
    Mild 20.78%
    Heather 19.32%
    Broom 19.24%
    Cedarleaf 19.22%
    Carrot 19.21%
    Genet 19.19%
    Green pepper 19.11%

     

    Odor impact est.
    Medium

  • Properties

    XLogP3-AA
    3.4

    pKa est.
    7.56 (neutral)

    Molecular weight
    219.32 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    303°C

    Flash point

    • 130.31 ˚C est.

  • Synonyms

    • Butanamide, 2-ethyl-N-methyl-N-(3-methylphenyl)-
    • 406488-30-0
    • 2-ethyl-n-methyl-n-(3-methylphenyl) butanamide
    • EC 446-190-2
    • DTXSID20889177
    • 2-ethyl-n-methyl-n-(3-methylphenyl)butanamide
    • SCHEMBL1183668
    • XATDMWWMSDQXFD-UHFFFAOYSA-N
    • DTXCID801028445
    • NS00008977
    • 446-190-2
    • 804-897-7
    • Paradisamide

  • Applications

    Butanamide, 2-ethyl-N-methyl-N-(3-methylphenyl)- (CAS 406488-30-0) is a versatile building block for chemical synthesis, commonly evaluated as an intermediate in pharmaceutical and agrochemical development; it can also serve as a precursor for arylamide dyes and pigment precursors used in specialty coatings and inks, and act as a functional building block in polymer and coating formulations. In research and development, it provides a scaffold for medicinal chemistry library expansion and SAR exploration. Subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 1633.26
    methanol 1789.9
    isopropanol 1530.27
    water 2.89
    ethyl acetate 2132.39
    n-propanol 1603.59
    acetone 2970.88
    n-butanol 1632.72
    acetonitrile 2686.04
    DMF 3109.04
    toluene 1133.86
    isobutanol 1459.33
    1,4-dioxane 2937.09
    methyl acetate 2010.76
    THF 2467.07
    2-butanone 2339.03
    n-pentanol 878.03
    sec-butanol 1389.52
    n-hexane 236.64
    ethylene glycol 148.1
    NMP 2181.46
    cyclohexane 477.56
    DMSO 1241.36
    n-butyl acetate 1581.68
    n-octanol 431.32
    chloroform 7942.2
    n-propyl acetate 1155.93
    acetic acid 1985.65
    dichloromethane 7276.96
    cyclohexanone 3673.25
    propylene glycol 246.78
    isopropyl acetate 1297.21
    DMAc 2107.69
    2-ethoxyethanol 922.65
    isopentanol 1448.6
    n-heptane 75.8
    ethyl formate 1449.57
    1,2-dichloroethane 4659.42
    n-hexanol 954.33
    2-methoxyethanol 1621.71
    isobutyl acetate 692.15
    tetrachloromethane 1113.91
    n-pentyl acetate 877.35
    transcutol 2095.67
    n-heptanol 452.01
    ethylbenzene 596.05
    MIBK 965.49
    2-propoxyethanol 1192.91
    tert-butanol 1543.13
    MTBE 1934.17
    2-butoxyethanol 719.3
    propionic acid 1345.81
    o-xylene 643.11
    formic acid 448.87
    diethyl ether 2171.56
    m-xylene 685.57
    p-xylene 852.76
    chlorobenzene 2131.64
    dimethyl carbonate 616.89
    n-octane 52.31
    formamide 829.6
    cyclopentanone 3006.62
    2-pentanone 1806.89
    anisole 972.94
    cyclopentyl methyl ether 1398.26
    gamma-butyrolactone 3081.08
    1-methoxy-2-propanol 1086.06
    pyridine 2790.28
    3-pentanone 1579.82
    furfural 2250.77
    n-dodecane 41.02
    diethylene glycol 587.58
    diisopropyl ether 513.47
    tert-amyl alcohol 1342.0
    acetylacetone 1609.27
    n-hexadecane 50.0
    acetophenone 895.58
    methyl propionate 1423.53
    isopentyl acetate 1319.16
    trichloroethylene 7733.73
    n-nonanol 375.64
    cyclohexanol 1550.74
    benzyl alcohol 771.05
    2-ethylhexanol 538.49
    isooctanol 382.15
    dipropyl ether 606.36
    1,2-dichlorobenzene 1672.56
    ethyl lactate 363.94
    propylene carbonate 1728.2
    n-methylformamide 1600.12
    2-pentanol 1037.66
    n-pentane 203.99
    1-propoxy-2-propanol 805.8
    1-methoxy-2-propyl acetate 928.56
    2-(2-methoxypropoxy) propanol 447.55
    mesitylene 418.27
    ε-caprolactone 2530.34
    p-cymene 265.02
    epichlorohydrin 3414.82
    1,1,1-trichloroethane 4004.37
    2-aminoethanol 451.38
    morpholine-4-carbaldehyde 1978.9
    sulfolane 2312.14
    2,2,4-trimethylpentane 108.22
    2-methyltetrahydrofuran 2289.36
    n-hexyl acetate 1057.18
    isooctane 73.26
    2-(2-butoxyethoxy)ethanol 710.37
    sec-butyl acetate 720.94
    tert-butyl acetate 1082.45
    decalin 172.1
    glycerin 295.3
    diglyme 1414.02
    acrylic acid 1136.53
    isopropyl myristate 328.31
    n-butyric acid 2175.68
    acetyl acetate 1292.09
    di(2-ethylhexyl) phthalate 294.7
    ethyl propionate 897.75
    nitromethane 3016.67
    1,2-diethoxyethane 1249.61
    benzonitrile 1299.46
    trioctyl phosphate 224.28
    1-bromopropane 2325.08
    gamma-valerolactone 3172.85
    n-decanol 257.87
    triethyl phosphate 316.96
    4-methyl-2-pentanol 507.36
    propionitrile 1914.33
    vinylene carbonate 1751.86
    1,1,2-trichlorotrifluoroethane 1695.72
    DMS 813.56
    cumene 355.14
    2-octanol 358.84
    2-hexanone 1097.47
    octyl acetate 459.77
    limonene 395.49
    1,2-dimethoxyethane 1952.65
    ethyl orthosilicate 309.76
    tributyl phosphate 306.18
    diacetone alcohol 874.38
    N,N-dimethylaniline 562.49
    acrylonitrile 2034.61
    aniline 1265.45
    1,3-propanediol 917.11
    bromobenzene 2328.25
    dibromomethane 4437.12
    1,1,2,2-tetrachloroethane 5626.07
    2-methyl-cyclohexyl acetate 545.22
    tetrabutyl urea 362.6
    diisobutyl methanol 267.03
    2-phenylethanol 706.26
    styrene 791.65
    dioctyl adipate 403.73
    dimethyl sulfate 783.81
    ethyl butyrate 803.26
    methyl lactate 447.38
    butyl lactate 526.89
    diethyl carbonate 542.49
    propanediol butyl ether 497.34
    triethyl orthoformate 489.91
    p-tert-butyltoluene 250.09
    methyl 4-tert-butylbenzoate 582.57
    morpholine 2938.66
    tert-butylamine 1052.99
    n-dodecanol 187.82
    dimethoxymethane 1479.75
    ethylene carbonate 1607.57
    cyrene 497.56
    2-ethoxyethyl acetate 972.18
    2-ethylhexyl acetate 984.92
    1,2,4-trichlorobenzene 1701.0
    4-methylpyridine 2666.6
    dibutyl ether 616.96
    2,6-dimethyl-4-heptanol 267.03
    DEF 1984.42
    dimethyl isosorbide 876.48
    tetrachloroethylene 3699.9
    eugenol 560.75
    triacetin 638.93
    span 80 456.57
    1,4-butanediol 325.69
    1,1-dichloroethane 4722.31
    2-methyl-1-pentanol 867.75
    methyl formate 1300.69
    2-methyl-1-butanol 1442.57
    n-decane 70.5
    butyronitrile 2058.28
    3,7-dimethyl-1-octanol 386.92
    1-chlorooctane 375.6
    1-chlorotetradecane 131.72
    n-nonane 66.68
    undecane 52.18
    tert-butylcyclohexane 138.58
    cyclooctane 107.33
    cyclopentanol 1318.96
    tetrahydropyran 3094.73
    tert-amyl methyl ether 1115.85
    2,5,8-trioxanonane 729.58
    1-hexene 766.42
    2-isopropoxyethanol 635.63
    2,2,2-trifluoroethanol 723.21
    methyl butyrate 1401.33

    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