Hymexazol

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  • Identifiers

    CAS number
    10004-44-1

    Molecular formula
    C4H5NO2

    SMILES
    CC1=CC(=O)NO1

    Safety labels

    Corrosive
    Corrosive

    Irritant
    Irritant

    Health Hazard
    Health

    Environmental Hazard
    Environmental

  • Odor profile

    Fragrance
    Caramellic 52.05%
    Fruity 45.33%
    Nutty 43.25%
    Burnt 42.4%
    Roasted 38.15%
    Sweet 36.49%
    Coffee 27.84%
    Musty 24.02%
    Cocoa 22.89%
    Strawberry 22.51%

     

    Flavor
    Sweet 39.78%
    Almond 38.82%
    Caramel 37.33%
    Nutty 34.86%
    Bread 32.57%
    Musty 30.75%
    Cocoa 30.53%
    Coffee 30.28%
    Fruity 29.16%
    Woody 27.26%

     

    Odor impact est.
    High

  • Properties

    XLogP3-AA
    0.1

    pKa est.
    8.08 (weak base)

    Molecular weight
    99.09 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Slow

    Boiling point est.
    232°C

    Flash point

    • 92.73 ˚C est.

  • Synonyms

    • Hymexazol
    • 10004-44-1
    • 3-Hydroxy-5-methylisoxazole
    • 5-Methylisoxazol-3-ol
    • Hymexazole
    • Tachigaren
    • Hydroxyisoxazole
    • 5-Methyl-3-hydroxyisoxazole
    • 5-METHYL-3(2H)-ISOXAZOLONE
    • SF-6505
    • F 319
    • F-319
    • NSC 217971
    • 5-methylisoxazol-3-one
    • DTXSID3032622
    • 20T2M875LO
    • NSC-217971
    • CHEBI:5827
    • DTXCID1012622
    • RTY-319
    • RefChem:789581
    • 233-000-6
    • 5-methylisoxazol-3(2H)-one
    • 3(2H)-Isoxazolone, 5-methyl-
    • Itachigarden
    • Bucide
    • 5-Methyl-isoxazol-3-ol
    • 3-Isoxazolol, 5-methyl-
    • Hydroxyisoxazole (pesticide)
    • 5-methyl-3-isoxazolol
    • 5-Methyl-1,2-oxazol-3-one
    • Isoxazole, 3-hydroxy-5-methyl-
    • MFCD00144468
    • NSC217971
    • 5-methyl-1,2-oxazol-3-ol
    • Butsid
    • Bucid
    • 5-methyl-1,2-oxazol-3(2H)-one
    • Hymexazol 100 microg/mL in Acetonitrile
    • Hymexazol [BSI:ISO]
    • EINECS 233-000-6
    • 5-methyl-2,3-dihydro-1,2-oxazol-3-one
    • UNII-20T2M875LO
    • 5-methylisoxazole-3-ol
    • HYMEXAZOL [ISO]
    • HYMEXAZOL [MI]
    • SCHEMBL20728
    • SCHEMBL20729
    • WLN: T5NOJ C1 EQ
    • 5-Methyl-2H-isoxazol-3-one
    • CHEMBL244877
    • SCHEMBL2124100
    • SCHEMBL7789790
    • 5-methyl-2-hydroisoxazol-3-one
    • ALBB-022606
    • BB_SC-10988
    • MSK21021
    • Tox21_300856
    • BBL033480
    • SBB055813
    • STL313888
    • AKOS001021985
    • AKOS003620478
    • 3-Hydroxy-5-methylisoxazole, >=90%
    • CS-W011330
    • FH24278
    • PS-9334
    • s10286
    • NCGC00248192-01
    • NCGC00254759-01
    • BP-21478
    • NCI60_001815
    • SY007361
    • CAS-10004-44-1
    • H1348
    • NS00004518
    • EN300-07726
    • UPCMLD00X10004-44-1:001
    • 004H441
    • A800021
    • F068627
    • Q16512783
    • Z56761467
    • Hymexazol; CE10-30-60; KGVPNLBXJKTABS-UHFFFAOYSA-N
    • InChI=1/C4H5NO2/c1-3-2-4(6)5-7-3/h2H,1H3,(H,5,6
    • 10004-44-1

  • Applications

    Hymexazol (CAS 10004-44-1) is a fungicidal active ingredient used in agriculture and horticulture to control soil- and seed-borne diseases. It is commonly formulated for seed treatments and soil drenches to protect germinating seedlings from damping-off pathogens such as Pythium and Rhizoctonia, improving crop establishment in vegetables, root crops and ornamental plants. In greenhouse and field operations, hymexazol-containing products are applied as seed coatings, transplant dips or soil applications as part of disease-management programs. It may be used in nurseries and seed production settings to reduce losses from soil-borne fungi, with uses governed by local regulatory approvals and formulation limits.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 97.99
    methanol 153.6
    isopropanol 79.86
    water 129.38
    ethyl acetate 23.19
    n-propanol 66.03
    acetone 96.17
    n-butanol 47.38
    acetonitrile 59.1
    DMF 383.99
    toluene 4.06
    isobutanol 51.72
    1,4-dioxane 63.96
    methyl acetate 43.03
    THF 72.42
    2-butanone 50.49
    n-pentanol 35.97
    sec-butanol 53.91
    n-hexane 1.26
    ethylene glycol 96.12
    NMP 218.52
    cyclohexane 0.77
    DMSO 214.55
    n-butyl acetate 10.15
    n-octanol 17.83
    chloroform 12.21
    n-propyl acetate 14.9
    acetic acid 103.84
    dichloromethane 15.35
    cyclohexanone 40.81
    propylene glycol 103.53
    isopropyl acetate 13.37
    DMAc 334.67
    2-ethoxyethanol 93.07
    isopentanol 42.1
    n-heptane 1.22
    ethyl formate 28.69
    1,2-dichloroethane 11.8
    n-hexanol 17.76
    2-methoxyethanol 187.84
    isobutyl acetate 10.4
    tetrachloromethane 2.58
    n-pentyl acetate 10.68
    transcutol 149.28
    n-heptanol 12.5
    ethylbenzene 3.93
    MIBK 20.85
    2-propoxyethanol 52.56
    tert-butanol 78.26
    MTBE 24.18
    2-butoxyethanol 32.68
    propionic acid 54.34
    o-xylene 6.64
    formic acid 134.65
    diethyl ether 18.22
    m-xylene 5.68
    p-xylene 6.45
    chlorobenzene 5.77
    dimethyl carbonate 27.51
    n-octane 0.67
    formamide 153.25
    cyclopentanone 58.12
    2-pentanone 31.31
    anisole 21.23
    cyclopentyl methyl ether 23.73
    gamma-butyrolactone 67.25
    1-methoxy-2-propanol 124.48
    pyridine 27.27
    3-pentanone 24.26
    furfural 74.82
    n-dodecane 0.94
    diethylene glycol 82.03
    diisopropyl ether 5.45
    tert-amyl alcohol 57.64
    acetylacetone 36.73
    n-hexadecane 0.99
    acetophenone 24.25
    methyl propionate 34.21
    isopentyl acetate 11.77
    trichloroethylene 21.79
    n-nonanol 15.91
    cyclohexanol 27.8
    benzyl alcohol 25.94
    2-ethylhexanol 10.77
    isooctanol 11.16
    dipropyl ether 9.05
    1,2-dichlorobenzene 7.67
    ethyl lactate 23.33
    propylene carbonate 33.97
    n-methylformamide 139.75
    2-pentanol 28.17
    n-pentane 1.29
    1-propoxy-2-propanol 34.74
    1-methoxy-2-propyl acetate 20.53
    2-(2-methoxypropoxy) propanol 51.45
    mesitylene 4.06
    ε-caprolactone 37.59
    p-cymene 4.34
    epichlorohydrin 55.97
    1,1,1-trichloroethane 8.91
    2-aminoethanol 114.37
    morpholine-4-carbaldehyde 158.57
    sulfolane 91.3
    2,2,4-trimethylpentane 1.41
    2-methyltetrahydrofuran 41.59
    n-hexyl acetate 18.54
    isooctane 0.92
    2-(2-butoxyethoxy)ethanol 58.47
    sec-butyl acetate 10.33
    tert-butyl acetate 16.53
    decalin 1.19
    glycerin 153.28
    diglyme 87.03
    acrylic acid 62.71
    isopropyl myristate 8.96
    n-butyric acid 36.73
    acetyl acetate 15.29
    di(2-ethylhexyl) phthalate 14.08
    ethyl propionate 16.2
    nitromethane 146.92
    1,2-diethoxyethane 22.28
    benzonitrile 17.69
    trioctyl phosphate 9.49
    1-bromopropane 6.24
    gamma-valerolactone 96.19
    n-decanol 12.47
    triethyl phosphate 10.25
    4-methyl-2-pentanol 18.0
    propionitrile 31.87
    vinylene carbonate 32.34
    1,1,2-trichlorotrifluoroethane 69.69
    DMS 19.59
    cumene 4.57
    2-octanol 9.76
    2-hexanone 20.83
    octyl acetate 12.37
    limonene 5.84
    1,2-dimethoxyethane 100.54
    ethyl orthosilicate 9.49
    tributyl phosphate 11.21
    diacetone alcohol 44.45
    N,N-dimethylaniline 21.41
    acrylonitrile 46.5
    aniline 17.34
    1,3-propanediol 102.05
    bromobenzene 3.59
    dibromomethane 7.63
    1,1,2,2-tetrachloroethane 18.75
    2-methyl-cyclohexyl acetate 12.3
    tetrabutyl urea 18.79
    diisobutyl methanol 7.86
    2-phenylethanol 16.44
    styrene 4.09
    dioctyl adipate 15.63
    dimethyl sulfate 55.34
    ethyl butyrate 10.96
    methyl lactate 47.03
    butyl lactate 17.66
    diethyl carbonate 9.48
    propanediol butyl ether 50.03
    triethyl orthoformate 10.52
    p-tert-butyltoluene 4.2
    methyl 4-tert-butylbenzoate 26.32
    morpholine 84.69
    tert-butylamine 32.59
    n-dodecanol 9.87
    dimethoxymethane 102.13
    ethylene carbonate 23.62
    cyrene 55.23
    2-ethoxyethyl acetate 18.04
    2-ethylhexyl acetate 8.84
    1,2,4-trichlorobenzene 12.07
    4-methylpyridine 32.33
    dibutyl ether 10.87
    2,6-dimethyl-4-heptanol 7.86
    DEF 61.18
    dimethyl isosorbide 52.27
    tetrachloroethylene 11.76
    eugenol 31.69
    triacetin 26.43
    span 80 33.73
    1,4-butanediol 53.68
    1,1-dichloroethane 11.1
    2-methyl-1-pentanol 30.83
    methyl formate 88.79
    2-methyl-1-butanol 42.14
    n-decane 1.32
    butyronitrile 24.9
    3,7-dimethyl-1-octanol 17.6
    1-chlorooctane 5.02
    1-chlorotetradecane 2.67
    n-nonane 1.14
    undecane 1.08
    tert-butylcyclohexane 1.39
    cyclooctane 0.4
    cyclopentanol 41.34
    tetrahydropyran 27.67
    tert-amyl methyl ether 21.38
    2,5,8-trioxanonane 74.94
    1-hexene 4.48
    2-isopropoxyethanol 53.33
    2,2,2-trifluoroethanol 57.26
    methyl butyrate 22.74

    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