Prosulfocarb

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  • Identifiers

    CAS number
    52888-80-9

    Molecular formula
    C14H21NOS

    SMILES
    CCCN(CCC)C(=O)SCC1=CC=CC=C1

    Safety labels

    Irritant
    Irritant

    Environmental Hazard
    Environmental

  • Odor profile

    Fragrance
    Fruity 46.24%
    Grapefruit 43.81%
    Meaty 39.28%
    Tropical 37.12%
    Sulfurous 36.99%
    Citrus 35.15%
    Herbal 34.72%
    Savory 34.0%
    Roasted 31.28%
    Grape 27.69%

     

    Flavor
    Green 30.3%
    Herbal 27.05%
    Mild 23.69%
    Roasted 21.48%
    Metallic 20.8%
    Tomato leaf 20.24%
    Sulfury 20.11%
    Syrup 19.95%
    Green pepper 19.66%
    Carrot 19.63%

     

    Odor impact est.
    Low

  • Properties

    XLogP3-AA
    3.9

    pKa est.
    7.63 (neutral)

    Molecular weight
    251.39 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Ultra slow

    Boiling point est.
    359°C

    Flash point

    • 155.68 ˚C est.

  • Synonyms

    • Prosulfocarb
    • 52888-80-9
    • Arkade
    • Defi
    • Prosulfurocarb herbicide
    • Boxer (ICI Agrochemicals)
    • Benzyl dipropylthiolcarbamate
    • S-(Phenylmethyl) dipropylcarbamothioate
    • 8VCE6FU50D
    • SC 0574
    • R 15574
    • DTXSID3058119
    • CHEBI:81941
    • RefChem:176635
    • DTXCID6031887
    • 401-730-6
    • S-Benzyl dipropylthiocarbamate
    • Prosulfocarb [ISO]
    • S-benzyl N,N-dipropylcarbamothioate
    • S-benzyl dipropylcarbamothioate
    • MFCD00145179
    • S-Benzyl N,N-dipropylthiocarbamate
    • S-Benzyl dipropylthiolcarbamate
    • S-Benzyl dipropyl thiolcarbamate
    • RCRA waste no. U387
    • UNII-8VCE6FU50D
    • S-Benzyl dipropylthiocarbamate (IUPAC)
    • BRN 4804364
    • S-Benzyl-N,N-dipropylthiocarbamat [German]
    • S-Benzyl-N,N-dipropylthiocarbamat
    • N,N-Dipropylthiocarbamate de S-benzyle [French]
    • N,N-dipropyl(benzylsulfanyl)formamide
    • Carbamothioic acid, dipropyl-, S-(phenylmethyl) ester
    • N,N-Dipropylthiocarbamate de S-benzyle
    • Prosulfocarb (Standard)
    • Prosulfocarb 10 microg/mL in Acetonitrile
    • Carbamic acid, dipropylthio-, S-benzyl ester
    • EC 401-730-6
    • SCHEMBL20845
    • orb1705585
    • CHEMBL2251843
    • MSK22413
    • AKOS016011247
    • SS-4633
    • S-BENZYL DIPROPYL(THIOCARBAMATE)
    • CS-0104673
    • NS00010887
    • C18760
    • F87965
    • Prosulfocarb, PESTANAL(R), analytical standard
    • S-(PHENYLMETHYL) N,N-DIPROPYLCARBAMOTHIOATE
    • Q22808799
    • 52888-80-9

  • Applications

    Prosulfocarb (CAS 52888-80-9) is a thiocarbamate herbicide used primarily in agriculture as a pre-emergence weed control agent in cereal crops (such as wheat and barley) and some other crops, aiming to suppress annual grasses and certain broadleaf weeds to reduce competition and improve crop establishment. It is typically applied as a soil-applied formulation (e.g., emulsifiable concentrate or water-dispersible granules) and may be used in tank mixes with other herbicides, with effectiveness dependent on soil type, moisture, and timing, and subject to local regulations and label requirements.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 402.84
    methanol 468.46
    isopropanol 276.6
    water 0.32
    ethyl acetate 862.14
    n-propanol 352.32
    acetone 1311.38
    n-butanol 384.81
    acetonitrile 807.96
    DMF 2073.44
    toluene 591.51
    isobutanol 292.99
    1,4-dioxane 935.18
    methyl acetate 875.32
    THF 1069.3
    2-butanone 986.01
    n-pentanol 304.26
    sec-butanol 272.86
    n-hexane 34.46
    ethylene glycol 55.13
    NMP 1753.34
    cyclohexane 90.17
    DMSO 1129.03
    n-butyl acetate 826.91
    n-octanol 165.92
    chloroform 3417.58
    n-propyl acetate 675.53
    acetic acid 589.87
    dichloromethane 3761.3
    cyclohexanone 1717.65
    propylene glycol 86.58
    isopropyl acetate 499.4
    DMAc 1522.31
    2-ethoxyethanol 426.84
    isopentanol 339.81
    n-heptane 23.85
    ethyl formate 676.46
    1,2-dichloroethane 2573.47
    n-hexanol 282.18
    2-methoxyethanol 583.7
    isobutyl acetate 384.06
    tetrachloromethane 326.79
    n-pentyl acetate 499.91
    transcutol 1245.29
    n-heptanol 162.68
    ethylbenzene 270.76
    MIBK 442.54
    2-propoxyethanol 479.93
    tert-butanol 276.12
    MTBE 398.02
    2-butoxyethanol 338.17
    propionic acid 439.81
    o-xylene 313.14
    formic acid 148.65
    diethyl ether 499.79
    m-xylene 323.21
    p-xylene 335.01
    chlorobenzene 1124.55
    dimethyl carbonate 328.39
    n-octane 16.51
    formamide 329.63
    cyclopentanone 1733.41
    2-pentanone 800.4
    anisole 528.37
    cyclopentyl methyl ether 583.11
    gamma-butyrolactone 1809.64
    1-methoxy-2-propanol 400.56
    pyridine 1522.32
    3-pentanone 687.04
    furfural 1584.95
    n-dodecane 15.64
    diethylene glycol 284.19
    diisopropyl ether 131.29
    tert-amyl alcohol 281.56
    acetylacetone 893.25
    n-hexadecane 18.9
    acetophenone 654.02
    methyl propionate 673.0
    isopentyl acetate 588.15
    trichloroethylene 4519.87
    n-nonanol 146.22
    cyclohexanol 455.63
    benzyl alcohol 437.36
    2-ethylhexanol 202.43
    isooctanol 145.13
    dipropyl ether 229.72
    1,2-dichlorobenzene 1055.33
    ethyl lactate 219.31
    propylene carbonate 1025.73
    n-methylformamide 852.17
    2-pentanol 240.32
    n-pentane 30.76
    1-propoxy-2-propanol 358.34
    1-methoxy-2-propyl acetate 520.11
    2-(2-methoxypropoxy) propanol 268.33
    mesitylene 181.58
    ε-caprolactone 1246.32
    p-cymene 149.23
    epichlorohydrin 2115.72
    1,1,1-trichloroethane 1625.94
    2-aminoethanol 154.79
    morpholine-4-carbaldehyde 1236.87
    sulfolane 1674.53
    2,2,4-trimethylpentane 27.32
    2-methyltetrahydrofuran 861.75
    n-hexyl acetate 517.91
    isooctane 18.67
    2-(2-butoxyethoxy)ethanol 387.96
    sec-butyl acetate 402.01
    tert-butyl acetate 433.5
    decalin 54.25
    glycerin 122.54
    diglyme 831.32
    acrylic acid 449.58
    isopropyl myristate 167.26
    n-butyric acid 708.38
    acetyl acetate 544.39
    di(2-ethylhexyl) phthalate 172.58
    ethyl propionate 483.08
    nitromethane 1454.62
    1,2-diethoxyethane 630.72
    benzonitrile 863.92
    trioctyl phosphate 116.93
    1-bromopropane 921.28
    gamma-valerolactone 1919.86
    n-decanol 102.99
    triethyl phosphate 200.64
    4-methyl-2-pentanol 141.02
    propionitrile 627.55
    vinylene carbonate 1041.22
    1,1,2-trichlorotrifluoroethane 1008.67
    DMS 455.8
    cumene 163.64
    2-octanol 134.38
    2-hexanone 585.16
    octyl acetate 221.59
    limonene 215.87
    1,2-dimethoxyethane 853.0
    ethyl orthosilicate 188.39
    tributyl phosphate 157.93
    diacetone alcohol 389.45
    N,N-dimethylaniline 323.63
    acrylonitrile 879.95
    aniline 566.67
    1,3-propanediol 262.41
    bromobenzene 1263.97
    dibromomethane 2102.49
    1,1,2,2-tetrachloroethane 3123.54
    2-methyl-cyclohexyl acetate 321.64
    tetrabutyl urea 224.02
    diisobutyl methanol 114.55
    2-phenylethanol 363.56
    styrene 409.18
    dioctyl adipate 244.85
    dimethyl sulfate 508.74
    ethyl butyrate 480.7
    methyl lactate 238.09
    butyl lactate 323.52
    diethyl carbonate 326.41
    propanediol butyl ether 282.01
    triethyl orthoformate 283.4
    p-tert-butyltoluene 132.72
    methyl 4-tert-butylbenzoate 336.93
    morpholine 1022.77
    tert-butylamine 181.61
    n-dodecanol 78.85
    dimethoxymethane 725.17
    ethylene carbonate 855.49
    cyrene 341.29
    2-ethoxyethyl acetate 620.03
    2-ethylhexyl acetate 504.89
    1,2,4-trichlorobenzene 1085.12
    4-methylpyridine 1462.63
    dibutyl ether 269.63
    2,6-dimethyl-4-heptanol 114.55
    DEF 1031.17
    dimethyl isosorbide 525.06
    tetrachloroethylene 1803.59
    eugenol 361.11
    triacetin 416.75
    span 80 253.87
    1,4-butanediol 148.12
    1,1-dichloroethane 1911.46
    2-methyl-1-pentanol 293.9
    methyl formate 692.4
    2-methyl-1-butanol 336.85
    n-decane 25.81
    butyronitrile 742.66
    3,7-dimethyl-1-octanol 153.64
    1-chlorooctane 164.36
    1-chlorotetradecane 60.62
    n-nonane 23.23
    undecane 19.25
    tert-butylcyclohexane 42.25
    cyclooctane 25.38
    cyclopentanol 411.96
    tetrahydropyran 934.65
    tert-amyl methyl ether 316.18
    2,5,8-trioxanonane 468.95
    1-hexene 193.2
    2-isopropoxyethanol 306.19
    2,2,2-trifluoroethanol 229.8
    methyl butyrate 784.44

    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