2-(Trimethylammonio)ethyl methacrylate chloride

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  • Identifiers

    CAS number
    5039-78-1

    Molecular formula
    C9H18ClNO2

    SMILES
    CC(=C)C(=O)OCC[N+](C)(C)C.[Cl-]

    Safety labels

    Irritant
    Irritant

  • Odor profile

    Fruity 70.09%
    Herbal 45.49%
    Ethereal 35.9%
    Mint 34.73%
    Pungent 32.93%
    Camphoreous 26.89%
    Sharp 26.46%
    Sweet 25.91%
    Sour 25.36%
    Chamomile 25.28%

    Scent© AI

  • Properties

    Molecular weight
    207.7 g/mol

    Flash point est.
    -78.76 ˚C

  • Synonyms

    • 5039-78-1
    • 2-(methacryloyloxy)-N,N,N-trimethylethanaminium chloride
    • (2-(Methacryloyloxy)ethyl)trimethylammonium chloride
    • Methacrylatoethyl trimethyl ammonium chloride
    • UNII-41QWS48DFN
    • UNII-PP88R88K3O
    • PP88R88K3O
    • [2-(methacryloyloxy)ethyl]trimethylammonium chloride
    • (2-(Methacryloyloxy)ethyl)trimethylammonium
    • Ethanaminium, N,N,N-trimethyl-2-[(2-methyl-1-oxo-2-propenyl)oxy]-,chloride
    • EINECS 225-733-5
    • DTXSID3027586
    • trimethyl-[2-(2-methylprop-2-enoyloxy)ethyl]azanium;chloride
    • 2-(trimethylammonio)ethyl methacrylate chloride
    • EC 225-733-5
    • Ethanaminium, N,N,N-trimethyl-2-((2-methyl-1-oxo-2-propenyl)oxy)-, chloride
    • CHOLINE, CHLORIDE METHACRYLATE
    • N,N,N-(2-trimethylammonio)ethyl methacrylate chloride
    • 2-methacryloxyethyltrimethylammonium chloride
    • dimethylaminoethyl methacrylate methochloride
    • Ethanaminium, N,N,N-trimethyl-2-[(2-methyl-1-oxo-2-propenyl)oxy]-, chloride
    • (2-(methacryloyloxy)ethyl) trimethylammonium chloride
    • 2-(METHACRYLOYLOXY)ETHYLTRIMETHYLAMMONIUM CHLORIDE
    • (2-(METHACRYLOYLOXY)ETHYL)TRIMETHYL-AMMONIUM CHLORIDE
    • Ethanaminium, N,N,N-trimethyl-2-((2-methyl-1-oxo-2-propen-1-yl)oxy)-, chloride (1:1)
    • UNII-HU373G0YSU
    • Trimethylammoniumethylmethacrylic chloride(50cp(23 degrees c))
    • SynthalenCR
    • Synthalen CR
    • UNII-31L31U8285
    • Methacroylcholine Chloride
    • Trimethyl-2-methacroyloxyethylammonium Chloride
    • 41QWS48DFN
    • HU373G0YSU
    • SCHEMBL15954
    • UNII-67C1D6YV24
    • DTXCID507586
    • CHEMBL3187310
    • 67C1D6YV24
    • Tox21_202564
    • MFCD00060097
    • AKOS015903560
    • 2-(Methacryloyloxy)-N,N,N-trimethylethanaminium chloride (stabilized with MEHQ)
    • NCGC00164165-01
    • NCGC00260113-01
    • CAS-5039-78-1
    • DB-051765
    • 31L31U8285
    • M0918
    • methacryloyloxyethyltrimethylammonium chloride
    • NS00078334
    • betamethacrylyloxyethyl trimethyl ammonium chloride
    • Q27286691
    • 2-Methacryloxyethyltrimethylammonium chloride,70% soln. in water
    • Methacroylcholine Chloride (ca. 80% in Water) (stabilized with MEHQ)
    • Methacroylcholine Chloride, (ca. 80 Percent in Water) (stabilized with MEHQ)
    • 2-(Methacryloyloxy)-N,N,N-trimethylethanaminium chloride (stabilized with MEHQ, 80% in water)
    • 2-(Methacryloyloxy)-N,N,N-trimethylethanaminium chloride, 80% (in water)(stabilized with MEHQ)

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 818.81
    methanol 2113.83
    isopropanol 226.16
    water 1279.5
    ethyl acetate 31.31
    n-propanol 380.04
    acetone 77.45
    n-butanol 181.37
    acetonitrile 49.78
    DMF 411.16
    toluene 2.51
    isobutanol 159.36
    1,4-dioxane 86.86
    methyl acetate 83.21
    THF 74.71
    2-butanone 45.56
    n-pentanol 75.85
    sec-butanol 136.78
    n-hexane 2.1
    ethylene glycol 973.06
    NMP 344.78
    cyclohexane 2.53
    DMSO 180.02
    n-butyl acetate 18.7
    n-octanol 20.46
    chloroform 153.72
    n-propyl acetate 24.99
    acetic acid 1859.59
    dichloromethane 116.72
    cyclohexanone 50.67
    propylene glycol 551.29
    isopropyl acetate 11.31
    DMAc 344.02
    2-ethoxyethanol 342.66
    isopentanol 67.94
    n-heptane 1.49
    ethyl formate 121.99
    1,2-dichloroethane 48.78
    n-hexanol 50.7
    2-methoxyethanol 1045.55
    isobutyl acetate 14.99
    tetrachloromethane 31.65
    n-pentyl acetate 17.14
    transcutol 291.11
    n-heptanol 37.87
    ethylbenzene 2.48
    MIBK 8.53
    2-propoxyethanol 189.71
    tert-butanol 125.79
    MTBE 20.28
    2-butoxyethanol 135.23
    propionic acid 479.61
    o-xylene 4.47
    formic acid 3854.37
    diethyl ether 22.62
    m-xylene 2.99
    p-xylene 4.47
    chlorobenzene 7.86
    dimethyl carbonate 30.02
    n-octane 0.65
    formamide 2733.15
    cyclopentanone 64.76
    2-pentanone 16.4
    anisole 10.42
    cyclopentyl methyl ether 21.01
    gamma-butyrolactone 160.91
    1-methoxy-2-propanol 254.67
    pyridine 53.22
    3-pentanone 15.79
    furfural 203.12
    n-dodecane 0.48
    diethylene glycol 339.19
    diisopropyl ether 3.01
    tert-amyl alcohol 105.48
    acetylacetone 21.97
    n-hexadecane 0.5
    acetophenone 21.1
    methyl propionate 49.3
    isopentyl acetate 15.69
    trichloroethylene 130.07
    n-nonanol 18.41
    cyclohexanol 64.15
    benzyl alcohol 41.79
    2-ethylhexanol 16.67
    isooctanol 24.64
    dipropyl ether 8.6
    1,2-dichlorobenzene 12.18
    ethyl lactate 46.58
    propylene carbonate 78.77
    n-methylformamide 672.42
    2-pentanol 42.73
    n-pentane 2.69
    1-propoxy-2-propanol 69.25
    1-methoxy-2-propyl acetate 30.85
    2-(2-methoxypropoxy) propanol 66.76
    mesitylene 2.32
    ε-caprolactone 82.38
    p-cymene 4.12
    epichlorohydrin 135.19
    1,1,1-trichloroethane 27.73
    2-aminoethanol 1069.35
    morpholine-4-carbaldehyde 306.87
    sulfolane 137.75
    2,2,4-trimethylpentane 1.6
    2-methyltetrahydrofuran 47.22
    n-hexyl acetate 23.51
    isooctane 0.59
    2-(2-butoxyethoxy)ethanol 100.51
    sec-butyl acetate 10.39
    tert-butyl acetate 12.12
    decalin 1.22
    glycerin 910.94
    diglyme 171.33
    acrylic acid 567.88
    isopropyl myristate 5.86
    n-butyric acid 270.53
    acetyl acetate 23.55
    di(2-ethylhexyl) phthalate 19.09
    ethyl propionate 16.82
    nitromethane 761.0
    1,2-diethoxyethane 20.33
    benzonitrile 16.57
    trioctyl phosphate 12.49
    1-bromopropane 13.65
    gamma-valerolactone 197.6
    n-decanol 11.6
    triethyl phosphate 14.12
    4-methyl-2-pentanol 15.37
    propionitrile 33.73
    vinylene carbonate 92.77
    1,1,2-trichlorotrifluoroethane 496.46
    DMS 30.73
    cumene 3.5
    2-octanol 14.19
    2-hexanone 15.96
    octyl acetate 11.57
    limonene 5.48
    1,2-dimethoxyethane 150.17
    ethyl orthosilicate 13.63
    tributyl phosphate 13.77
    diacetone alcohol 47.55
    N,N-dimethylaniline 13.16
    acrylonitrile 67.71
    aniline 27.72
    1,3-propanediol 873.74
    bromobenzene 4.2
    dibromomethane 52.36
    1,1,2,2-tetrachloroethane 111.92
    2-methyl-cyclohexyl acetate 19.66
    tetrabutyl urea 18.88
    diisobutyl methanol 6.4
    2-phenylethanol 33.48
    styrene 2.53
    dioctyl adipate 15.2
    dimethyl sulfate 61.01
    ethyl butyrate 13.21
    methyl lactate 91.79
    butyl lactate 41.32
    diethyl carbonate 12.12
    propanediol butyl ether 114.89
    triethyl orthoformate 14.31
    p-tert-butyltoluene 4.23
    methyl 4-tert-butylbenzoate 35.43
    morpholine 201.26
    tert-butylamine 47.65
    n-dodecanol 7.54
    dimethoxymethane 116.11
    ethylene carbonate 62.63
    cyrene 88.62
    2-ethoxyethyl acetate 39.11
    2-ethylhexyl acetate 12.38
    1,2,4-trichlorobenzene 21.96
    4-methylpyridine 25.9
    dibutyl ether 5.11
    2,6-dimethyl-4-heptanol 6.4
    DEF 66.78
    dimethyl isosorbide 68.86
    tetrachloroethylene 128.65
    eugenol 52.82
    triacetin 44.74
    span 80 62.99
    1,4-butanediol 252.05
    1,1-dichloroethane 30.61
    2-methyl-1-pentanol 40.28
    methyl formate 372.24
    2-methyl-1-butanol 95.47
    n-decane 0.81
    butyronitrile 23.05
    3,7-dimethyl-1-octanol 13.49
    1-chlorooctane 3.71
    1-chlorotetradecane 1.42
    n-nonane 0.74
    undecane 0.6
    tert-butylcyclohexane 1.18
    cyclooctane 0.82
    cyclopentanol 101.9
    tetrahydropyran 32.68
    tert-amyl methyl ether 17.32
    2,5,8-trioxanonane 96.24
    1-hexene 5.35
    2-isopropoxyethanol 118.04
    2,2,2-trifluoroethanol 830.96
    methyl butyrate 29.86

    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