Flutriafol

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  • Identifiers

    CAS number
    76674-21-0

    Molecular formula
    C16H13F2N3O

    SMILES
    C1=CC=C(C(=C1)C(CN2C=NC=N2)(C3=CC=C(C=C3)F)O)F

    Safety labels

    Irritant
    Irritant

    Environmental Hazard
    Environmental

  • Odor profile

    Fragrance
    Floral 45.26%
    Fruity 41.2%
    Grape 38.71%
    Sweet 36.25%
    Odorless 32.07%
    Neroli 29.17%
    Animal 28.52%
    Orange 23.77%
    Rose 22.65%
    Fatty 22.59%

     

    Flavor
    Bitter 76.72%
    Odorless 36.43%
    Mild 26.05%
    Sweet-like 20.66%
    Very strong 20.15%
    Indole 19.72%
    Nitrile 19.68%
    Orange flower 19.49%
    Fruity 19.44%
    Orange blossom 19.28%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    2.3

    pKa est.
    5.27 (weak acid)

    Molecular weight
    301.29 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    629°C

    Flash point

    • 201.07 ˚C est.

  • Synonyms

    • Flutriafol
    • 76674-21-0
    • PP 450
    • TOPGUARD
    • 1-(2-Fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethanol
    • R 152450
    • 83P8CT2Z3H
    • DTXSID8040727
    • alpha-(2-Fluorophenyl)-alpha-(4-fluorophenyl)-1H-1,2,4-triazole-1-ethanol
    • PP-450
    • (RS)-2,4'-Difluoro-alpha-(1H-1,2,4-triazol-1-ylmethyl)benzhydryl alcohol
    • DTXCID6020727
    • CHEBI:83707
    • 1H-1,2,4-Triazole-1-ethanol, alpha-(2-fluorophenyl)-alpha-(4-fluorophenyl)-
    • R-152450
    • RefChem:141076
    • CHEBI:81923
    • 616-367-0
    • 687-648-3
    • Impact
    • MFCD00144319
    • 1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)ethanol
    • 1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1H-1,2,4-triazol-1-yl)ethan-1-ol
    • (1R)-1-(2-fluorophenyl)-1-(4-fluorophenyl)-2-(1,2,4-triazol-1-yl)ethanol
    • 1H-1,2,4-Triazole-1-ethanol, .alpha.-(2-fluorophenyl)-.alpha.-(4-fluorophenyl)-
    • Impact (pesticide)
    • Flutriafol [BSI:ISO]
    • Flutriafol [ISO]
    • UNII-83P8CT2Z3H
    • Flutriafol 10 microg/mL in Acetonitrile
    • FLUTRIAFOL [MI]
    • Impact Excel (Salt/Mix)
    • Oprea1_336494
    • Oprea1_365445
    • SCHEMBL24004
    • Impact 2000 (Salt/Mix)
    • orb1299431
    • CHEMBL2136951
    • SCHEMBL29360204
    • MSK21178
    • Tox21_301338
    • AKOS015915013
    • HY-W019852
    • NCGC00164269-01
    • NCGC00255461-01
    • DA-73415
    • FF104206
    • SY464817
    • CAS-76674-21-0
    • CS-0031644
    • NS00000704
    • Flutriafol, PESTANAL(R), analytical standard
    • C18734
    • G12381
    • 674F210
    • A838792
    • AG-690/11665165
    • Q1434425
    • .alpha.-(2-Fluorophenyl)-.alpha.-(4-fluorophenyl)-1H-1,2,4-triazole-1-ethanol
    • 76674-21-0

  • Applications

    Flutriafol (CAS 76674-21-0) is a systemic triazole fungicide used in agriculture to protect crops from fungal diseases by inhibiting ergosterol biosynthesis. Its typical applications include foliar sprays and soil treatments to protect a range of crops, and in some cases it is used as seed treatment; it is applied on cereals, fruits and vegetables, and on crops grown in greenhouses or in open-field production; it is often formulated in combination products with other fungicides and is subject to local regulations and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 75.88
    methanol 168.0
    isopropanol 45.75
    water 0.17
    ethyl acetate 96.67
    n-propanol 58.52
    acetone 207.51
    n-butanol 41.22
    acetonitrile 123.7
    DMF 137.7
    toluene 23.52
    isobutanol 37.41
    1,4-dioxane 115.67
    methyl acetate 98.98
    THF 247.05
    2-butanone 161.9
    n-pentanol 37.57
    sec-butanol 43.34
    n-hexane 0.22
    ethylene glycol 28.62
    NMP 81.28
    cyclohexane 0.52
    DMSO 355.6
    n-butyl acetate 30.99
    n-octanol 14.72
    chloroform 87.41
    n-propyl acetate 50.53
    acetic acid 99.95
    dichloromethane 124.09
    cyclohexanone 110.8
    propylene glycol 36.94
    isopropyl acetate 46.55
    DMAc 236.95
    2-ethoxyethanol 123.14
    isopentanol 38.72
    n-heptane 0.75
    ethyl formate 67.19
    1,2-dichloroethane 71.7
    n-hexanol 23.8
    2-methoxyethanol 210.81
    isobutyl acetate 25.33
    tetrachloromethane 3.5
    n-pentyl acetate 24.97
    transcutol 337.84
    n-heptanol 16.77
    ethylbenzene 11.3
    MIBK 49.94
    2-propoxyethanol 89.38
    tert-butanol 59.19
    MTBE 27.04
    2-butoxyethanol 54.38
    propionic acid 50.54
    o-xylene 13.35
    formic acid 76.7
    diethyl ether 32.83
    m-xylene 12.24
    p-xylene 15.35
    chlorobenzene 24.21
    dimethyl carbonate 58.07
    n-octane 0.34
    formamide 182.07
    cyclopentanone 129.34
    2-pentanone 87.35
    anisole 56.9
    cyclopentyl methyl ether 40.34
    gamma-butyrolactone 141.23
    1-methoxy-2-propanol 129.56
    pyridine 113.43
    3-pentanone 68.11
    furfural 134.12
    n-dodecane 0.72
    diethylene glycol 104.24
    diisopropyl ether 6.78
    tert-amyl alcohol 43.7
    acetylacetone 131.69
    n-hexadecane 0.83
    acetophenone 63.68
    methyl propionate 76.74
    isopentyl acetate 29.95
    trichloroethylene 150.87
    n-nonanol 15.92
    cyclohexanol 30.3
    benzyl alcohol 56.29
    2-ethylhexanol 16.43
    isooctanol 15.87
    dipropyl ether 23.27
    1,2-dichlorobenzene 21.4
    ethyl lactate 46.16
    propylene carbonate 67.92
    n-methylformamide 109.85
    2-pentanol 22.78
    n-pentane 0.25
    1-propoxy-2-propanol 61.0
    1-methoxy-2-propyl acetate 61.94
    2-(2-methoxypropoxy) propanol 77.06
    mesitylene 6.73
    ε-caprolactone 84.93
    p-cymene 10.21
    epichlorohydrin 199.91
    1,1,1-trichloroethane 30.56
    2-aminoethanol 56.94
    morpholine-4-carbaldehyde 139.51
    sulfolane 150.37
    2,2,4-trimethylpentane 0.54
    2-methyltetrahydrofuran 78.25
    n-hexyl acetate 31.66
    isooctane 0.4
    2-(2-butoxyethoxy)ethanol 102.05
    sec-butyl acetate 31.84
    tert-butyl acetate 44.19
    decalin 0.72
    glycerin 68.56
    diglyme 179.77
    acrylic acid 55.02
    isopropyl myristate 17.0
    n-butyric acid 61.41
    acetyl acetate 57.59
    di(2-ethylhexyl) phthalate 22.24
    ethyl propionate 51.14
    nitromethane 265.46
    1,2-diethoxyethane 66.56
    benzonitrile 54.24
    trioctyl phosphate 14.13
    1-bromopropane 22.85
    gamma-valerolactone 182.29
    n-decanol 12.72
    triethyl phosphate 24.11
    4-methyl-2-pentanol 16.8
    propionitrile 83.27
    vinylene carbonate 68.94
    1,1,2-trichlorotrifluoroethane 124.66
    DMS 44.55
    cumene 7.84
    2-octanol 11.03
    2-hexanone 58.88
    octyl acetate 21.12
    limonene 12.73
    1,2-dimethoxyethane 186.65
    ethyl orthosilicate 21.33
    tributyl phosphate 17.63
    diacetone alcohol 83.4
    N,N-dimethylaniline 33.44
    acrylonitrile 112.35
    aniline 43.79
    1,3-propanediol 75.02
    bromobenzene 21.13
    dibromomethane 50.62
    1,1,2,2-tetrachloroethane 88.79
    2-methyl-cyclohexyl acetate 32.36
    tetrabutyl urea 30.63
    diisobutyl methanol 12.24
    2-phenylethanol 41.34
    styrene 15.18
    dioctyl adipate 31.96
    dimethyl sulfate 82.02
    ethyl butyrate 36.74
    methyl lactate 67.1
    butyl lactate 33.7
    diethyl carbonate 30.76
    propanediol butyl ether 52.85
    triethyl orthoformate 30.21
    p-tert-butyltoluene 8.84
    methyl 4-tert-butylbenzoate 48.54
    morpholine 125.18
    tert-butylamine 18.25
    n-dodecanol 9.77
    dimethoxymethane 174.53
    ethylene carbonate 56.26
    cyrene 78.38
    2-ethoxyethyl acetate 51.77
    2-ethylhexyl acetate 21.11
    1,2,4-trichlorobenzene 30.71
    4-methylpyridine 76.15
    dibutyl ether 17.98
    2,6-dimethyl-4-heptanol 12.24
    DEF 75.7
    dimethyl isosorbide 112.92
    tetrachloroethylene 40.76
    eugenol 57.08
    triacetin 55.55
    span 80 44.87
    1,4-butanediol 31.67
    1,1-dichloroethane 47.37
    2-methyl-1-pentanol 34.78
    methyl formate 105.71
    2-methyl-1-butanol 33.78
    n-decane 0.97
    butyronitrile 58.38
    3,7-dimethyl-1-octanol 18.2
    1-chlorooctane 5.99
    1-chlorotetradecane 3.13
    n-nonane 0.65
    undecane 0.83
    tert-butylcyclohexane 0.7
    cyclooctane 0.2
    cyclopentanol 35.29
    tetrahydropyran 66.69
    tert-amyl methyl ether 26.04
    2,5,8-trioxanonane 143.36
    1-hexene 2.76
    2-isopropoxyethanol 73.6
    2,2,2-trifluoroethanol 44.48
    methyl butyrate 64.08

    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