Amine dithiocarbamate

  • Identifiers

    Molecular formula
    CH6N2S2

    SMILES
    C(=S)(N)S.N

  • Odor profile

    Fragrance
    Sulfurous 69.55%
    Meaty 47.36%
    Garlic 45.03%
    Onion 44.57%
    Roasted 36.35%
    Alliaceous 36.12%
    Savory 34.82%
    Odorless 34.18%
    Cooked 34.05%
    Pungent 33.21%

     

    Flavor
    Odorless 35.94%
    Pungent 33.43%
    Mustard 29.05%
    Garlic 28.73%
    Sulfur 28.24%
    Sulfurous 25.74%
    Formyl 22.22%
    Mousy 21.86%
    Sulfury 21.43%
    Rotten 21.11%

     

    Odor impact est.
    Medium

  • Properties

    pKa est.
    5.51 (weak acid)

    Molecular weight
    110.21 g/mol

    Vapor pressure est.

    • hPa @ 20°C
    • hPa @ 25°C

    Evaporation rate
    Moderately slow

    Boiling point est.
    237°C

    Flash point

    • 39.85 ˚C est.

  • Synonyms

    • amine dithiocarbamate
    • NSC202959
    • AKOS037652452
    • ES-2016
    • CS-0187303
    • Q10880295
    • Dithio-carbamic Acid Monoammonium Salt; Carbamodithioic Acid Monoammonium Salt;
  • Applications

    Amine dithiocarbamate is primarily used as a versatile synthesis intermediate and ligand in chemistry. It serves as a precursor for dithiocarbamate-based agrochemicals, including fungicide formulations, and as a versatile chelating agent capable of binding metal ions in cleaning products, water treatment formulations, and cosmetic systems. In addition, the amine-dithiocarbamate framework is employed as ligands in coordination chemistry and catalyst development, and as a building block for functional polymers and coatings. In mineral processing, related dithiocarbamate derivatives are used as flotation reagents to separate minerals.

    gpt-5-nano

  • Solubility @25˚C

    Solvent Solubility (g/L)
    ethanol 99.61
    methanol 198.36
    isopropanol 68.62
    water 112.67
    ethyl acetate 49.66
    n-propanol 66.74
    acetone 190.85
    n-butanol 53.57
    acetonitrile 83.82
    DMF 444.85
    toluene 6.3
    isobutanol 42.44
    1,4-dioxane 91.45
    methyl acetate 73.8
    THF 169.43
    2-butanone 101.69
    n-pentanol 45.2
    sec-butanol 46.66
    n-hexane 1.34
    ethylene glycol 137.75
    NMP 190.04
    cyclohexane 1.19
    DMSO 255.66
    n-butyl acetate 37.43
    n-octanol 30.15
    chloroform 19.75
    n-propyl acetate 43.27
    acetic acid 166.42
    dichloromethane 15.65
    cyclohexanone 63.3
    propylene glycol 124.0
    isopropyl acetate 34.94
    DMAc 275.99
    2-ethoxyethanol 128.88
    isopentanol 37.12
    n-heptane 3.2
    ethyl formate 58.55
    1,2-dichloroethane 15.12
    n-hexanol 43.45
    2-methoxyethanol 226.11
    isobutyl acetate 30.59
    tetrachloromethane 6.15
    n-pentyl acetate 34.36
    transcutol 143.67
    n-heptanol 35.56
    ethylbenzene 3.44
    MIBK 41.4
    2-propoxyethanol 136.43
    tert-butanol 66.59
    MTBE 36.11
    2-butoxyethanol 95.0
    propionic acid 76.66
    o-xylene 6.18
    formic acid 196.59
    diethyl ether 32.81
    m-xylene 6.66
    p-xylene 4.95
    chlorobenzene 8.88
    dimethyl carbonate 70.55
    n-octane 1.39
    formamide 190.48
    cyclopentanone 129.01
    2-pentanone 71.3
    anisole 27.55
    cyclopentyl methyl ether 43.19
    gamma-butyrolactone 116.68
    1-methoxy-2-propanol 161.63
    pyridine 44.09
    3-pentanone 50.29
    furfural 126.32
    n-dodecane 1.39
    diethylene glycol 175.48
    diisopropyl ether 9.42
    tert-amyl alcohol 47.61
    acetylacetone 96.65
    n-hexadecane 1.45
    acetophenone 36.42
    methyl propionate 63.88
    isopentyl acetate 30.0
    trichloroethylene 31.35
    n-nonanol 27.5
    cyclohexanol 26.17
    benzyl alcohol 34.99
    2-ethylhexanol 20.51
    isooctanol 24.63
    dipropyl ether 25.94
    1,2-dichlorobenzene 8.68
    ethyl lactate 51.54
    propylene carbonate 58.05
    n-methylformamide 193.42
    2-pentanol 31.77
    n-pentane 1.98
    1-propoxy-2-propanol 92.39
    1-methoxy-2-propyl acetate 61.01
    2-(2-methoxypropoxy) propanol 78.31
    mesitylene 4.35
    ε-caprolactone 53.13
    p-cymene 6.67
    epichlorohydrin 92.05
    1,1,1-trichloroethane 15.42
    2-aminoethanol 128.47
    morpholine-4-carbaldehyde 197.2
    sulfolane 137.73
    2,2,4-trimethylpentane 1.39
    2-methyltetrahydrofuran 60.67
    n-hexyl acetate 38.54
    isooctane 1.3
    2-(2-butoxyethoxy)ethanol 96.72
    sec-butyl acetate 25.0
    tert-butyl acetate 40.17
    decalin 0.92
    glycerin 211.57
    diglyme 150.53
    acrylic acid 96.12
    isopropyl myristate 17.06
    n-butyric acid 69.28
    acetyl acetate 40.93
    di(2-ethylhexyl) phthalate 25.21
    ethyl propionate 35.36
    nitromethane 235.2
    1,2-diethoxyethane 41.6
    benzonitrile 25.89
    trioctyl phosphate 21.2
    1-bromopropane 7.12
    gamma-valerolactone 176.58
    n-decanol 21.14
    triethyl phosphate 19.88
    4-methyl-2-pentanol 21.14
    propionitrile 45.1
    vinylene carbonate 54.27
    1,1,2-trichlorotrifluoroethane 119.32
    DMS 35.97
    cumene 3.66
    2-octanol 21.0
    2-hexanone 50.89
    octyl acetate 27.81
    limonene 9.52
    1,2-dimethoxyethane 151.4
    ethyl orthosilicate 18.14
    tributyl phosphate 20.53
    diacetone alcohol 82.97
    N,N-dimethylaniline 23.02
    acrylonitrile 67.17
    aniline 25.31
    1,3-propanediol 121.24
    bromobenzene 5.05
    dibromomethane 8.45
    1,1,2,2-tetrachloroethane 26.36
    2-methyl-cyclohexyl acetate 27.63
    tetrabutyl urea 33.25
    diisobutyl methanol 12.41
    2-phenylethanol 37.88
    styrene 4.59
    dioctyl adipate 29.28
    dimethyl sulfate 102.95
    ethyl butyrate 30.68
    methyl lactate 90.1
    butyl lactate 43.96
    diethyl carbonate 22.36
    propanediol butyl ether 94.96
    triethyl orthoformate 26.17
    p-tert-butyltoluene 7.7
    methyl 4-tert-butylbenzoate 50.71
    morpholine 110.63
    tert-butylamine 28.14
    n-dodecanol 15.95
    dimethoxymethane 178.23
    ethylene carbonate 43.69
    cyrene 88.36
    2-ethoxyethyl acetate 49.74
    2-ethylhexyl acetate 21.66
    1,2,4-trichlorobenzene 14.22
    4-methylpyridine 36.64
    dibutyl ether 14.94
    2,6-dimethyl-4-heptanol 12.41
    DEF 81.68
    dimethyl isosorbide 99.02
    tetrachloroethylene 18.62
    eugenol 68.12
    triacetin 51.31
    span 80 69.45
    1,4-butanediol 74.74
    1,1-dichloroethane 16.52
    2-methyl-1-pentanol 28.45
    methyl formate 157.62
    2-methyl-1-butanol 35.02
    n-decane 1.99
    butyronitrile 39.55
    3,7-dimethyl-1-octanol 21.1
    1-chlorooctane 7.11
    1-chlorotetradecane 3.6
    n-nonane 1.78
    undecane 1.6
    tert-butylcyclohexane 1.22
    cyclooctane 0.71
    cyclopentanol 50.75
    tetrahydropyran 42.89
    tert-amyl methyl ether 28.66
    2,5,8-trioxanonane 120.74
    1-hexene 4.81
    2-isopropoxyethanol 82.82
    2,2,2-trifluoroethanol 118.57
    methyl butyrate 47.16

    Scent© AI

1 of 4
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