Vinclozolin

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  • Identifiers

    CAS number
    50471-44-8

    Molecular formula
    C12H9Cl2NO3

    SMILES
    CC1(C(=O)N(C(=O)O1)C2=CC(=CC(=C2)Cl)Cl)C=C

    Safety labels

    Irritant
    Irritant

    Health Hazard
    Health

    Environmental Hazard
    Environmental

  • Odor profile

    Odorless 45.9%
    Fruity 28.12%
    Grape 23.96%
    Bitter 21.31%
    Citrus 19.85%
    Sweet 19.82%
    Dry 18.72%
    Burnt 18.37%
    Floral 18.19%
    Spicy 18.18%

    Scent© AI

  • Properties

    XLogP3-AA
    3.1

    Molecular weight
    286.11 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Melting point expt.

    • 108 °C

    Boiling point

    • BP: 131 °C at 0.05 mm Hg

    Flash point est.
    150.83 ˚C

    Solubility expt.

    • White solid. MP 106-109 °C. Solubility in toluene 10.9; acetone33.4, methanol 1.54 (mg/L, 20 °C) (technical)
    • In water, 2.6 mg/L at 20 °C
    • In acetone = 435; benzene = 146; chloroform = 319; ethyl acetate = 253 (g/kg)
    • In methanol 1.54, acetone 33.4, ethyl acetate 23.3, n-heptane 0.45, toluene 10.9, dichloromethane 47.5 (all in g/100 mL at 20 °C).

  • Synonyms

    • VINCLOZOLIN
    • 50471-44-8
    • Ronilan
    • Vinclozoline
    • Ornalin
    • Vorlan
    • Vinchlozoline
    • Vinclozolin [German]
    • Caswell No. 323C
    • Vinclozolin [BSI:ISO]
    • BAS 352 F
    • Ronilan 50WP
    • Vinclozolin [ISO]
    • Vinclozoline [ISO-French]
    • BAS 35204F
    • Vinclozalin
    • Vinclozlin
    • CCRIS 9141
    • Ronilon
    • 3-(3,5-Dichlorophenyl)-5-ethenyl-5-methyl-2,4-oxazolidinedione
    • HSDB 6747
    • UNII-JJ258EZN1I
    • EINECS 256-599-6
    • 2,4-Oxazolidinedione, 3-(3,5-dichlorophenyl)-5-ethenyl-5-methyl-
    • JJ258EZN1I
    • EPA Pesticide Chemical Code 113201
    • BRN 1080192
    • DTXSID4022361
    • CHEBI:83732
    • 3-(3,5-dichlorophenyl)-5-ethenyl-5-methyl-1,3-oxazolidine-2,4-dione
    • 3-(3,5-Dichlorophenyl)-5-methyl-5-vinyl-1,3-oxazolidine-2,4-dione
    • VINCLOZOLIN [MI]
    • Ronilan FL (Salt/Mix)
    • VINCLOZOLIN [HSDB]
    • N-3,5-Dichlorophenyl-5-methyl-5-vinyl-1,3-oxazolidine-2,4-dione
    • Mascot contact turf fungicide
    • DTXCID002361
    • VINCLOZOLIN, (+/-)-
    • 2,4-Oxazolidinedione, 3-(3,5-dichlorophenyl)-5-methyl-5-vinyl-
    • 3-(3,5-Dichlorphenyl)-5-methyl-5-vinyl-1,3-oxazolidin-2,4-dion
    • 3-(3,5-Dichlorphenyl)-5-methyl-5-vinyl-1,3-oxazolidin-2,4-dion [German]
    • Vinclozolin 10 microg/mL in Isooctane
    • Vinclozolin 100 microg/mL in Cyclohexane
    • 3-(3,5-dichlorophenyl)-5-methyl-5-vinyloxazolidine-2,4-dione
    • Vinclozoline (ISO-French)
    • 3-(3,5-dichlorophenyl)-5-methyl-5-vinyl-oxazolidine-2,4-dione
    • Oxazolidinedione, 3-(3,5-dichlorophenyl)-5-ethenyl-5-methyl-
    • (+/-)-3-(3,5-DICHLOROPHENYL)-5-ETHENYL-5-METHYL-2,4-OXAZOLIDINEDIONE
    • CAS-50471-44-8
    • bas 352f
    • rac-vinclozolin
    • racemic vinclozolin
    • (RS)-vinclozolin
    • BAS 35202F
    • (+-)-vinclozolin
    • BAS 35204
    • zolidine-2,4-dione
    • (+ or -)-3-(3,5-dichlorophenyl)-5-ethenyl-5-methyl-2,4-oxazolidinedione
    • Oprea1_496886
    • Oprea1_674584
    • SCHEMBL21851
    • CHEBI:9986
    • CHEMBL513221
    • BAS352-04F
    • HMS1698A06
    • ACA47144
    • Tox21_202160
    • Tox21_301101
    • MFCD00055511
    • AKOS000545958
    • USEPA/OPP Pesticide Code: 11320
    • Vinclozolin 1000 microg/mL in Acetone
    • NCGC00163961-01
    • NCGC00163961-02
    • NCGC00163961-03
    • NCGC00163961-04
    • NCGC00163961-05
    • NCGC00163961-06
    • NCGC00255001-01
    • NCGC00259709-01
    • AS-82034
    • DB-051781
    • NS00000531
    • A12576
    • Vinclozolin, PESTANAL(R), analytical standard
    • Q412907
    • 3(3,5Dichlorphenyl)5methyl5vinyl1,3oxazolidin2,4dion
    • N3,5Dichlorophenyl5methyl5vinyl1,3oxazolidine2,4dione
    • 2,4Oxazolidinedione, 3(3,5dichlorophenyl)5methyl5vinyl
    • 3(3,5Dichlorophenyl)5ethenyl5methyl2,4oxazolidinedione
    • 3(3,5Dichlorophenyl)5methyl5vinyl1,3oxazolidine2,4dione
    • 2,4Oxazolidinedione, 3(3,5dichlorophenyl)5ethenyl5methyl
    • 3-(3,5-Dichlorophenyl)-5-methyl-5-vinyl-2,4-oxazolidinedione
    • (-)-3-(3,5-Dichlorophenyl)-5-methyl-5-vinyloxazolidine-2,4-dione
    • rac-3-(3,5-dichlorophenyl)-5-ethenyl-5-methyl-2,4-oxazolidinedione
    • (+ or-)-3-(3,5-dichlorophenyl)-5-ethenyl-5-methyl-2,4-oxazolidinedione
    • (rs)-3-(3,5-dichlorophenyl)-5-methyl-5-vinyl-1,3-oxazolidine-2,4-dione
    • 2,4-OXAZOLIDINEDIONE, 3-(3,5-DICHLORPHENYL)-5-ETHENYL-5-METHYL-
    • 3-(3,5-Dichlorophenyl)-5-methyl-5-vinyl-1,3-oxazolidine-2,4-dione #
    • 152723-54-1

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 6.03
    methanol 6.52
    isopropanol 4.75
    water 0.0
    ethyl acetate 46.28
    n-propanol 6.77
    acetone 68.0
    n-butanol 7.91
    acetonitrile 19.99
    DMF 193.55
    toluene 15.84
    isobutanol 5.59
    1,4-dioxane 59.84
    methyl acetate 47.45
    THF 195.35
    2-butanone 77.74
    n-pentanol 8.89
    sec-butanol 8.88
    n-hexane 0.17
    ethylene glycol 1.37
    NMP 252.78
    cyclohexane 0.2
    DMSO 92.22
    n-butyl acetate 38.95
    n-octanol 4.61
    chloroform 100.69
    n-propyl acetate 41.96
    acetic acid 22.73
    dichloromethane 98.27
    cyclohexanone 110.03
    propylene glycol 3.53
    isopropyl acetate 33.76
    DMAc 270.81
    2-ethoxyethanol 35.68
    isopentanol 10.57
    n-heptane 0.27
    ethyl formate 30.93
    1,2-dichloroethane 48.97
    n-hexanol 10.42
    2-methoxyethanol 49.44
    isobutyl acetate 25.08
    tetrachloromethane 2.81
    n-pentyl acetate 23.65
    transcutol 75.87
    n-heptanol 7.36
    ethylbenzene 10.2
    MIBK 36.83
    2-propoxyethanol 57.92
    tert-butanol 8.74
    MTBE 15.13
    2-butoxyethanol 30.17
    propionic acid 16.49
    o-xylene 10.79
    formic acid 7.93
    diethyl ether 12.59
    m-xylene 10.61
    p-xylene 14.83
    chlorobenzene 33.51
    dimethyl carbonate 46.58
    n-octane 0.15
    formamide 21.94
    cyclopentanone 167.14
    2-pentanone 52.4
    anisole 54.78
    cyclopentyl methyl ether 42.58
    gamma-butyrolactone 172.54
    1-methoxy-2-propanol 48.1
    pyridine 87.42
    3-pentanone 41.59
    furfural 172.19
    n-dodecane 0.27
    diethylene glycol 32.34
    diisopropyl ether 4.21
    tert-amyl alcohol 13.15
    acetylacetone 101.08
    n-hexadecane 0.34
    acetophenone 68.2
    methyl propionate 52.4
    isopentyl acetate 37.78
    trichloroethylene 179.07
    n-nonanol 5.71
    cyclohexanol 12.57
    benzyl alcohol 37.54
    2-ethylhexanol 10.57
    isooctanol 7.52
    dipropyl ether 13.41
    1,2-dichlorobenzene 37.91
    ethyl lactate 32.85
    propylene carbonate 90.88
    n-methylformamide 46.57
    2-pentanol 6.38
    n-pentane 0.12
    1-propoxy-2-propanol 42.51
    1-methoxy-2-propyl acetate 69.5
    2-(2-methoxypropoxy) propanol 50.7
    mesitylene 5.63
    ε-caprolactone 93.71
    p-cymene 8.46
    epichlorohydrin 187.26
    1,1,1-trichloroethane 34.3
    2-aminoethanol 4.26
    morpholine-4-carbaldehyde 180.04
    sulfolane 194.69
    2,2,4-trimethylpentane 0.38
    2-methyltetrahydrofuran 75.58
    n-hexyl acetate 26.41
    isooctane 0.24
    2-(2-butoxyethoxy)ethanol 45.44
    sec-butyl acetate 30.35
    tert-butyl acetate 42.77
    decalin 0.58
    glycerin 10.68
    diglyme 87.22
    acrylic acid 21.89
    isopropyl myristate 15.14
    n-butyric acid 26.9
    acetyl acetate 37.92
    di(2-ethylhexyl) phthalate 22.78
    ethyl propionate 44.37
    nitromethane 99.23
    1,2-diethoxyethane 30.74
    benzonitrile 45.41
    trioctyl phosphate 12.88
    1-bromopropane 15.96
    gamma-valerolactone 220.13
    n-decanol 4.64
    triethyl phosphate 25.2
    4-methyl-2-pentanol 6.69
    propionitrile 19.48
    vinylene carbonate 83.52
    1,1,2-trichlorotrifluoroethane 114.08
    DMS 46.14
    cumene 7.27
    2-octanol 4.68
    2-hexanone 47.8
    octyl acetate 18.73
    limonene 10.85
    1,2-dimethoxyethane 92.05
    ethyl orthosilicate 20.69
    tributyl phosphate 17.17
    diacetone alcohol 56.45
    N,N-dimethylaniline 35.78
    acrylonitrile 37.0
    aniline 28.03
    1,3-propanediol 9.92
    bromobenzene 32.43
    dibromomethane 41.61
    1,1,2,2-tetrachloroethane 105.69
    2-methyl-cyclohexyl acetate 37.63
    tetrabutyl urea 29.02
    diisobutyl methanol 6.98
    2-phenylethanol 40.23
    styrene 14.67
    dioctyl adipate 29.63
    dimethyl sulfate 86.04
    ethyl butyrate 38.34
    methyl lactate 42.77
    butyl lactate 26.65
    diethyl carbonate 29.14
    propanediol butyl ether 23.7
    triethyl orthoformate 28.81
    p-tert-butyltoluene 8.04
    methyl 4-tert-butylbenzoate 50.14
    morpholine 78.4
    tert-butylamine 3.85
    n-dodecanol 3.73
    dimethoxymethane 85.41
    ethylene carbonate 54.84
    cyrene 83.47
    2-ethoxyethyl acetate 43.16
    2-ethylhexyl acetate 29.55
    1,2,4-trichlorobenzene 53.8
    4-methylpyridine 90.68
    dibutyl ether 7.99
    2,6-dimethyl-4-heptanol 6.98
    DEF 79.6
    dimethyl isosorbide 110.06
    tetrachloroethylene 42.88
    eugenol 52.98
    triacetin 46.42
    span 80 34.54
    1,4-butanediol 4.65
    1,1-dichloroethane 36.18
    2-methyl-1-pentanol 13.27
    methyl formate 47.98
    2-methyl-1-butanol 10.21
    n-decane 0.36
    butyronitrile 20.51
    3,7-dimethyl-1-octanol 7.79
    1-chlorooctane 3.25
    1-chlorotetradecane 1.81
    n-nonane 0.25
    undecane 0.31
    tert-butylcyclohexane 0.57
    cyclooctane 0.1
    cyclopentanol 16.88
    tetrahydropyran 35.4
    tert-amyl methyl ether 19.22
    2,5,8-trioxanonane 70.9
    1-hexene 2.24
    2-isopropoxyethanol 28.06
    2,2,2-trifluoroethanol 12.63
    methyl butyrate 57.24

    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