Sulfoxaflor

Overview IFRA Request a quote

  • Identifiers

    CAS number
    946578-00-3

    Molecular formula
    C10H10F3N3OS

    SMILES
    CC(C1=CN=C(C=C1)C(F)(F)F)S(=NC#N)(=O)C

    Safety labels

    Irritant
    Irritant

    Environmental Hazard
    Environmental

  • Odor profile

    Fragrance
    Odorless 51.78%
    Meaty 33.84%
    Roasted 32.62%
    Savory 27.74%
    Cooked 27.19%
    Sulfurous 19.34%
    Burnt 18.67%
    Beefy 18.54%
    Popcorn 18.26%
    Nutty 17.91%

     

    Flavor
    Bitter 70.43%
    Odorless 29.92%
    Bland 23.47%
    Roasted 19.97%
    Nitrile 19.19%
    Taco 18.38%
    Roasted peanuts 18.2%
    Bread crust 18.01%
    Scallion 17.95%
    Cooked 17.76%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    2.2

    pKa est.
    5.43 (weak acid)

    Molecular weight
    277.27 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Melting point expt.

    • 112 °C (99.7% purity)

    Boiling point

    • 167.7 °C (decomp) (99.7% purity)

    Flash point

    • 134.05 ˚C est.

    Solubility expt.

    • In water, 809 mg/L at 25 °C
    • Solubility in heptane 0.242 mg/L. Solubility (g/L) in xylene 0.743; 1,2-dichloroethane 39.6; methanol 93.1; acetone 2.17; ethyl acetate 95.2; octanol 1.66. (all at 20 °C)

  • Synonyms

    • Sulfoxaflor
    • 946578-00-3
    • Transform
    • XDE-208
    • 671W88OY8K
    • GF 2032
    • GF 2372
    • DTXSID0074687
    • GF-2032
    • GF-2372
    • RefChem:889707
    • DTXCID4048935
    • CHEBI:133305
    • N-(methyloxido(1-(6-(trifluoromethyl)-3-pyridinyl)ethyl)gamma(4)-sulfanylidene) cyanamide
    • 807-366-8
    • sulfoxaflor (ISO); (methyl(oxo)(1-(6-(trifluoromethyl)-3-pyridyl)ethyl)-lambda6-sulfanylidene)cyanamide
    • Sulfoxaflor [ISO]
    • Cyanamide,N-[methyloxido[1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]-l4-sulfanylidene]-
    • N-(methyloxido(1-(6-(trifluoromethyl)-3-pyridinyl)ethyl)-lambda4-sulfanylidene)cyanamide
    • GF 2032; GF 2372; XDE 208
    • sulfoxaflor A
    • sulfoxaflor B
    • UNII-671W88OY8K
    • XDE 208
    • GF 2032; GF 2372; Methyl[1-(2-trifluoromethylpyridin-5-yl)ethyl]-N-cyanosulfoximine; Sulfoxaflor; Transform; XDE 208, Cyanamide, N-[methyloxido[1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]-?4-sulfanylidene]-
    • Sulfoxaflor 100 microg/mL in Acetonitrile
    • SCHEMBL520711
    • orb1306808
    • CHEMBL2230078
    • SCHEMBL29688368
    • HSDB 8245
    • CHEBI:133306
    • MSK20444
    • EBC-03927
    • AKOS027322695
    • [methyl-oxo-[1-[6-(trifluoromethyl)pyridin-3-yl]ethyl]-lambda6-sulfanylidene]cyanamide
    • DA-58191
    • HY-118504
    • CS-0066179
    • Q14566721
    • Z3244811863
    • METHYL(1-(2-TRIFLUOROMETHYLPYRIDIN-5-YL)ETHYL)-N-CYANOSULFOXIMINE
    • [methyl(oxido){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-lambda(6)-sulfanylidene]cyanamide
    • [methyl(oxo){1-[6-(trifluoromethyl)-3-pyridyl]ethyl}-lambda6-sulfanylidene]cyanamide
    • [Methyl(oxo){1-[6-(trifluoromethyl)pyridin-3-yl]ethyl}-lambda~6~-sulfanylidene]cyanamide
    • [methyl-oxo-[1-[6-(trifluoromethyl)-3-pyridyl]ethyl]-lambda6-sulfanylidene]cyanamide
    • N-(methyl(oxo)(1-(6-(trifluoromethyl)pyridin-3-yl)ethyl)-l6-sulfanylidene)cyanamide
    • N-[Methyl-oxo-[1-[6-(trifluoromethyl)-3-pyridyl]ethyl]-lambda6-sulfanylidene]cyanamide
    • CYANAMIDE, N-(METHYLOXIDO(1-(6-(TRIFLUOROMETHYL)-3-PYRIDINYL)ETHYL)-.LAMBDA.4-SULFANYLIDENE)-
    • Cyanamide, N-[methyloxido[1-[6-(trifluoromethyl)-3-pyridinyl]ethyl]-.lamda.4-sulfanylidene]-
    • 946578-00-3

  • Applications

    Sulfoxaflor (CAS 946578-00-3) is a systemic insecticide in the sulfoximine class used in agriculture to control sap-sucking pests on a range of crops. Typical applications include protection of fruit and vegetable crops, field crops, and ornamentals and nursery crops (including greenhouse production); it is applied as a foliar spray or soil drench to enable plant uptake. The compound is often incorporated into integrated pest management programs and used in accordance with product labels, subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 27.58
    methanol 50.19
    isopropanol 12.1
    water 0.04
    ethyl acetate 54.59
    n-propanol 11.92
    acetone 181.74
    n-butanol 8.06
    acetonitrile 78.08
    DMF 292.86
    toluene 14.61
    isobutanol 5.9
    1,4-dioxane 61.2
    methyl acetate 71.45
    THF 167.96
    2-butanone 78.24
    n-pentanol 7.12
    sec-butanol 7.72
    n-hexane 0.26
    ethylene glycol 13.39
    NMP 317.42
    cyclohexane 0.43
    DMSO 708.73
    n-butyl acetate 29.95
    n-octanol 2.34
    chloroform 76.14
    n-propyl acetate 35.82
    acetic acid 75.92
    dichloromethane 120.27
    cyclohexanone 73.91
    propylene glycol 12.16
    isopropyl acetate 32.32
    DMAc 225.58
    2-ethoxyethanol 56.99
    isopentanol 6.66
    n-heptane 0.45
    ethyl formate 48.69
    1,2-dichloroethane 75.07
    n-hexanol 8.1
    2-methoxyethanol 109.53
    isobutyl acetate 11.55
    tetrachloromethane 4.25
    n-pentyl acetate 18.76
    transcutol 171.53
    n-heptanol 4.27
    ethylbenzene 6.51
    MIBK 23.21
    2-propoxyethanol 54.55
    tert-butanol 13.86
    MTBE 8.59
    2-butoxyethanol 25.62
    propionic acid 26.04
    o-xylene 9.02
    formic acid 78.13
    diethyl ether 16.88
    m-xylene 9.84
    p-xylene 8.85
    chlorobenzene 24.15
    dimethyl carbonate 52.26
    n-octane 0.17
    formamide 207.5
    cyclopentanone 160.46
    2-pentanone 53.55
    anisole 37.41
    cyclopentyl methyl ether 30.47
    gamma-butyrolactone 224.44
    1-methoxy-2-propanol 62.92
    pyridine 90.3
    3-pentanone 36.52
    furfural 250.15
    n-dodecane 0.16
    diethylene glycol 66.52
    diisopropyl ether 3.76
    tert-amyl alcohol 9.66
    acetylacetone 155.28
    n-hexadecane 0.18
    acetophenone 56.53
    methyl propionate 54.65
    isopentyl acetate 21.65
    trichloroethylene 184.76
    n-nonanol 2.71
    cyclohexanol 6.25
    benzyl alcohol 29.66
    2-ethylhexanol 5.0
    isooctanol 3.33
    dipropyl ether 10.39
    1,2-dichlorobenzene 26.39
    ethyl lactate 27.42
    propylene carbonate 84.51
    n-methylformamide 143.47
    2-pentanol 5.03
    n-pentane 0.31
    1-propoxy-2-propanol 32.32
    1-methoxy-2-propyl acetate 61.52
    2-(2-methoxypropoxy) propanol 45.43
    mesitylene 4.88
    ε-caprolactone 69.54
    p-cymene 5.74
    epichlorohydrin 233.04
    1,1,1-trichloroethane 35.57
    2-aminoethanol 17.77
    morpholine-4-carbaldehyde 232.6
    sulfolane 335.24
    2,2,4-trimethylpentane 0.19
    2-methyltetrahydrofuran 57.21
    n-hexyl acetate 16.26
    isooctane 0.18
    2-(2-butoxyethoxy)ethanol 51.05
    sec-butyl acetate 17.55
    tert-butyl acetate 37.0
    decalin 0.35
    glycerin 31.43
    diglyme 125.02
    acrylic acid 41.48
    isopropyl myristate 7.07
    n-butyric acid 28.04
    acetyl acetate 55.96
    di(2-ethylhexyl) phthalate 14.35
    ethyl propionate 31.08
    nitromethane 366.19
    1,2-diethoxyethane 37.62
    benzonitrile 37.56
    trioctyl phosphate 6.96
    1-bromopropane 15.05
    gamma-valerolactone 250.45
    n-decanol 2.24
    triethyl phosphate 17.52
    4-methyl-2-pentanol 3.33
    propionitrile 28.03
    vinylene carbonate 73.12
    1,1,2-trichlorotrifluoroethane 168.23
    DMS 47.78
    cumene 4.1
    2-octanol 2.31
    2-hexanone 32.67
    octyl acetate 9.99
    limonene 6.77
    1,2-dimethoxyethane 112.2
    ethyl orthosilicate 13.12
    tributyl phosphate 10.51
    diacetone alcohol 52.3
    N,N-dimethylaniline 22.72
    acrylonitrile 63.92
    aniline 24.99
    1,3-propanediol 23.6
    bromobenzene 23.42
    dibromomethane 53.96
    1,1,2,2-tetrachloroethane 113.22
    2-methyl-cyclohexyl acetate 23.91
    tetrabutyl urea 18.44
    diisobutyl methanol 3.79
    2-phenylethanol 28.62
    styrene 9.61
    dioctyl adipate 18.29
    dimethyl sulfate 130.53
    ethyl butyrate 27.31
    methyl lactate 49.09
    butyl lactate 21.57
    diethyl carbonate 22.23
    propanediol butyl ether 22.68
    triethyl orthoformate 19.03
    p-tert-butyltoluene 5.37
    methyl 4-tert-butylbenzoate 37.72
    morpholine 75.59
    tert-butylamine 4.82
    n-dodecanol 1.74
    dimethoxymethane 127.45
    ethylene carbonate 47.35
    cyrene 67.01
    2-ethoxyethyl acetate 52.46
    2-ethylhexyl acetate 16.4
    1,2,4-trichlorobenzene 41.4
    4-methylpyridine 73.57
    dibutyl ether 4.91
    2,6-dimethyl-4-heptanol 3.79
    DEF 66.0
    dimethyl isosorbide 114.11
    tetrachloroethylene 58.06
    eugenol 40.17
    triacetin 48.39
    span 80 26.2
    1,4-butanediol 9.11
    1,1-dichloroethane 40.31
    2-methyl-1-pentanol 5.94
    methyl formate 137.67
    2-methyl-1-butanol 5.3
    n-decane 0.22
    butyronitrile 20.3
    3,7-dimethyl-1-octanol 3.57
    1-chlorooctane 1.63
    1-chlorotetradecane 0.82
    n-nonane 0.17
    undecane 0.19
    tert-butylcyclohexane 0.31
    cyclooctane 0.17
    cyclopentanol 13.42
    tetrahydropyran 24.65
    tert-amyl methyl ether 8.45
    2,5,8-trioxanonane 94.2
    1-hexene 1.9
    2-isopropoxyethanol 29.01
    2,2,2-trifluoroethanol 42.68
    methyl butyrate 42.83

    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