Tralkoxydim

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  • Identifiers

    CAS number
    87820-88-0

    Molecular formula
    C20H27NO3

    SMILES
    CC/C(=N\OCC)/C1=C(CC(CC1=O)C2=C(C=C(C=C2C)C)C)O

    Safety labels

    Irritant
    Irritant

    Health Hazard
    Health

    Environmental Hazard
    Environmental

  • Odor profile

    Fragrance
    Floral 33.48%
    Sweet 26.66%
    Roasted 23.64%
    Animal 22.87%
    Dry 21.64%
    Fresh 21.04%
    Woody 20.44%
    Powdery 20.24%
    Spicy 19.86%
    Citrus 19.76%

     

    Flavor
    Bitter 56.3%
    Odorless 21.63%
    Parsley 20.36%
    Cedarleaf 20.16%
    Lovage 20.15%
    Leaves 19.9%
    Heather 19.29%
    Broom 19.18%
    Basil 19.14%
    Ethyl benzoate 19.09%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    4.1

    pKa est.
    6.96 (neutral)

    Molecular weight
    329.4 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    558°C

    Melting point expt.

    • 106 °C
    • MP: 99-104 °C /Technical/

    Flash point

    • 177.01 ˚C est.

    Solubility expt.

    • In organic solvents at 24 °C (g/l): methanol = 25, acetone = 89, toluene = 213, hexane = 18, ethyl acetate = 100, dichloromethane = >500
    • In water (20 °C) = 5 mg/l (pH 5), 6.7 mg/l (pH 6.5), 9800 mg/l (pH 9)

  • Synonyms

    • 87820-88-0
    • Achieve
    • Splendor
    • 39J71H3DDD
    • ICIA-0604
    • PP604
    • GRASP (PESTICIDE)
    • FD 4026
    • 2-[1-(ethoxyimino)propyl]-3-hydroxy-5-(2,4,6-trimethylphenyl)-2-cyclohexen-1-one
    • DTXCID9014973
    • DTXSID1034973
    • 2-(1-(Ethoxyimino)propyl)-3-hydroxy-5-(2,4,6-trimethylphenyl)-2-cyclohexen-1-one
    • 2-Cyclohexen-1-one, 2-(1-(ethoxyimino)propyl)-3-hydroxy-5-(2,4,6-trimethylphenyl)-
    • FD-4026
    • 2-(1-(Ethoxyimino)propyl)-3-hydroxy-5-mesitylcyclohex-2-enone
    • 2-(1-(Ethoxyimino)propyl)-3-hydroxy-5-(2,4,6-trimethylphenyl)cyclohex-2-enone
    • EPHTC
    • RefChem:190550
    • 2-((1E)-1-(ethoxyimino)propyl)-3-hydroxy-5-(2,4,6-trimethylphenyl)cyclohex-2-en-1-one
    • 618-075-9
    • Tralkoxidym
    • MFCD00145415
    • 1869922-68-8
    • 2-[(E)-N-ethoxy-C-ethylcarbonimidoyl]-3-hydroxy-5-(2,4,6-trimethylphenyl)cyclohex-2-en-1-one
    • UNII-39J71H3DDD
    • HSDB 7016
    • ICI-A 604
    • NCGC00163930-04
    • 4-(1-(Ethoxyimino)propyl)-5-hydroxy-2',4',6'-trimethyl-1,6-dihydro-[1,1'-biphenyl]-3(2H)-one
    • SCHEMBL54229
    • CHEBI:81948
    • MSK22548
    • Tox21_400001
    • AKOS015889486
    • KS-5283
    • NCGC00163930-01
    • Tralkoxydim 50 microg/mL in Acetonitrile
    • CAS-87820-88-0
    • C18769
    • 820T880
    • 2-(1-(ETHOXYIMINO)PROPYL)-3-HYDROXY-5-MESITYLCYCLOHEX-2- ENONE
    • 2-[(1E)-N-Ethoxypropanimidoyl]-3-hydroxy-5-mesityl-2-cyclohexen-1-one #
    • 2-(1-(ETHOXYIMINO)PROPYL)-3-HYDROXY-5-(2,4,6- TRIMETHYLPHENYL)CYCLOHEX-2-ENONE
    • 2-[(E)-N-ethoxy-C-ethyl-carbonimidoyl]-3-hydroxy-5-(2,4,6-trimethylphenyl)cyclohex-2-en-1-one
    • 87820-88-0

  • Applications

    Tralkoxydim (CAS 87820-88-0) is a selective herbicide used in agriculture to control grasses in cereal crops. It is typically applied post-emergence in cereal crops such as wheat, barley, and rice, formulated in common product forms including emulsifiable concentrates (EC), suspension concentrates (SC), or wettable powders (WP) for spray applications. Its mode of action is inhibition of the ACCase enzyme in grasses, disrupting fatty acid biosynthesis and causing selective grass death, enabling better crop competitiveness. Use is typically integrated into weed management programs and is subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 79.92
    methanol 100.48
    isopropanol 49.68
    water 0.06
    ethyl acetate 159.47
    n-propanol 75.54
    acetone 234.68
    n-butanol 74.22
    acetonitrile 99.61
    DMF 372.9
    toluene 171.01
    isobutanol 58.87
    1,4-dioxane 323.54
    methyl acetate 150.36
    THF 751.67
    2-butanone 159.57
    n-pentanol 57.97
    sec-butanol 45.59
    n-hexane 4.83
    ethylene glycol 10.06
    NMP 508.59
    cyclohexane 8.76
    DMSO 227.39
    n-butyl acetate 98.1
    n-octanol 17.06
    chloroform 697.53
    n-propyl acetate 88.48
    acetic acid 139.63
    dichloromethane 758.7
    cyclohexanone 349.99
    propylene glycol 16.86
    isopropyl acetate 101.73
    DMAc 391.54
    2-ethoxyethanol 90.9
    isopentanol 65.43
    n-heptane 2.16
    ethyl formate 77.38
    1,2-dichloroethane 437.35
    n-hexanol 50.99
    2-methoxyethanol 162.54
    isobutyl acetate 73.06
    tetrachloromethane 52.57
    n-pentyl acetate 72.13
    transcutol 231.44
    n-heptanol 23.91
    ethylbenzene 47.68
    MIBK 101.33
    2-propoxyethanol 151.86
    tert-butanol 57.61
    MTBE 74.87
    2-butoxyethanol 68.1
    propionic acid 78.46
    o-xylene 64.34
    formic acid 34.72
    diethyl ether 107.42
    m-xylene 84.3
    p-xylene 64.25
    chlorobenzene 233.35
    dimethyl carbonate 106.44
    n-octane 1.23
    formamide 57.91
    cyclopentanone 486.29
    2-pentanone 154.32
    anisole 113.41
    cyclopentyl methyl ether 247.92
    gamma-butyrolactone 523.73
    1-methoxy-2-propanol 116.71
    pyridine 331.87
    3-pentanone 126.73
    furfural 350.89
    n-dodecane 1.16
    diethylene glycol 99.77
    diisopropyl ether 23.92
    tert-amyl alcohol 46.25
    acetylacetone 226.41
    n-hexadecane 1.48
    acetophenone 122.48
    methyl propionate 153.07
    isopentyl acetate 95.3
    trichloroethylene 822.85
    n-nonanol 18.64
    cyclohexanol 88.8
    benzyl alcohol 101.08
    2-ethylhexanol 33.22
    isooctanol 21.52
    dipropyl ether 42.69
    1,2-dichlorobenzene 191.79
    ethyl lactate 45.82
    propylene carbonate 228.44
    n-methylformamide 123.36
    2-pentanol 39.99
    n-pentane 3.71
    1-propoxy-2-propanol 87.24
    1-methoxy-2-propyl acetate 142.88
    2-(2-methoxypropoxy) propanol 75.56
    mesitylene 37.27
    ε-caprolactone 277.29
    p-cymene 26.12
    epichlorohydrin 724.24
    1,1,1-trichloroethane 289.37
    2-aminoethanol 30.57
    morpholine-4-carbaldehyde 390.24
    sulfolane 504.18
    2,2,4-trimethylpentane 3.18
    2-methyltetrahydrofuran 361.54
    n-hexyl acetate 85.46
    isooctane 2.2
    2-(2-butoxyethoxy)ethanol 85.81
    sec-butyl acetate 65.6
    tert-butyl acetate 110.07
    decalin 6.93
    glycerin 28.38
    diglyme 195.37
    acrylic acid 79.8
    isopropyl myristate 29.32
    n-butyric acid 118.13
    acetyl acetate 129.99
    di(2-ethylhexyl) phthalate 48.63
    ethyl propionate 83.91
    nitromethane 255.31
    1,2-diethoxyethane 89.12
    benzonitrile 133.72
    trioctyl phosphate 26.66
    1-bromopropane 152.01
    gamma-valerolactone 555.41
    n-decanol 13.59
    triethyl phosphate 45.86
    4-methyl-2-pentanol 26.14
    propionitrile 84.25
    vinylene carbonate 203.41
    1,1,2-trichlorotrifluoroethane 284.5
    DMS 121.92
    cumene 29.75
    2-octanol 15.08
    2-hexanone 90.54
    octyl acetate 40.56
    limonene 35.98
    1,2-dimethoxyethane 180.24
    ethyl orthosilicate 42.64
    tributyl phosphate 35.63
    diacetone alcohol 112.25
    N,N-dimethylaniline 76.34
    acrylonitrile 118.24
    aniline 155.31
    1,3-propanediol 60.7
    bromobenzene 258.32
    dibromomethane 399.4
    1,1,2,2-tetrachloroethane 551.89
    2-methyl-cyclohexyl acetate 81.35
    tetrabutyl urea 50.46
    diisobutyl methanol 19.04
    2-phenylethanol 101.22
    styrene 66.46
    dioctyl adipate 55.75
    dimethyl sulfate 172.47
    ethyl butyrate 71.98
    methyl lactate 65.6
    butyl lactate 51.4
    diethyl carbonate 53.47
    propanediol butyl ether 42.9
    triethyl orthoformate 54.56
    p-tert-butyltoluene 24.68
    methyl 4-tert-butylbenzoate 98.55
    morpholine 357.78
    tert-butylamine 29.6
    n-dodecanol 10.02
    dimethoxymethane 299.93
    ethylene carbonate 172.89
    cyrene 119.85
    2-ethoxyethyl acetate 124.65
    2-ethylhexyl acetate 76.6
    1,2,4-trichlorobenzene 242.7
    4-methylpyridine 334.54
    dibutyl ether 29.45
    2,6-dimethyl-4-heptanol 19.04
    DEF 198.02
    dimethyl isosorbide 200.61
    tetrachloroethylene 310.38
    eugenol 92.42
    triacetin 96.79
    span 80 64.06
    1,4-butanediol 27.48
    1,1-dichloroethane 310.15
    2-methyl-1-pentanol 57.28
    methyl formate 118.21
    2-methyl-1-butanol 64.23
    n-decane 2.15
    butyronitrile 85.71
    3,7-dimethyl-1-octanol 22.01
    1-chlorooctane 17.87
    1-chlorotetradecane 6.46
    n-nonane 1.85
    undecane 1.53
    tert-butylcyclohexane 5.79
    cyclooctane 2.59
    cyclopentanol 108.15
    tetrahydropyran 287.23
    tert-amyl methyl ether 64.41
    2,5,8-trioxanonane 128.93
    1-hexene 26.21
    2-isopropoxyethanol 67.97
    2,2,2-trifluoroethanol 63.76
    methyl butyrate 104.21

    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