Record Information
Version1.0
Creation Date2009-06-19 21:58:49 UTC
Update Date2026-04-05 15:31:29 UTC
Accession NumberCHEM001250
Identification
Common NameZinc dimethyldithiocarbamate
ClassSmall Molecule
DescriptionZinc dimethyldithiocarbamate is a chemical compound of zinc. Zinc is a metallic element with the atomic number 30. It is found in nature most often as the mineral sphalerite. Though excess zinc in harmful, in smaller amounts it is an essential element for life, as it is a cofactor for over 300 enzymes and is found in just as many transcription factors. (2, 3)
Contaminant Sources
  • Clean Air Act Chemicals
  • HPV EPA Chemicals
  • IARC Carcinogens Group 3
  • T3DB toxins
  • ToxCast & Tox21 Chemicals
Contaminant Type
  • Amine
  • Carbamate
  • Household Toxin
  • Industrial/Workplace Toxin
  • Organic Compound
  • Organometallic
  • Pesticide
  • Synthetic Compound
  • Zinc Compound
Chemical Structure
Thumb
Synonyms
ValueSource
(T-4)-Bis(dimethylcarbamodithioato-kappas,kappas')zincChEBI
Bis(dimethylcarbamodithioato-S,s')zincChEBI
Bis(dimethyldithiocarbamato)zincChEBI
Bis-dimethyldithiocarbamate de zincChEBI
Dimethyldithiocarbamate zinc saltChEBI
Zinc bis(dimethyldithiocarbamate)ChEBI
Zinc bis(dimethyldithiocarbamoyl)disulphideChEBI
Zinc bis(dimethylthiocarbamoyl)disulfideChEBI
Bis-dimethyldithiocarbamic acid de zincGenerator
Dimethyldithiocarbamic acid zinc saltGenerator
Zinc bis(dimethyldithiocarbamic acid)Generator
Zinc bis(dimethyldithiocarbamoyl)disulfideGenerator
Zinc bis(dimethylthiocarbamoyl)disulphideGenerator
Zinc dimethyldithiocarbamic acidGenerator
MilbamMeSH
FuklasinMeSH
Cuman LMeSH
Dimethyldithiocarbamate, zincMeSH
ZerlateMeSH
Chemical FormulaC6H12N2S4Zn
Average Molecular Mass305.842 g/mol
Monoisotopic Mass303.917 g/mol
CAS Registry Number137-30-4
IUPAC Namebis[(dimethylcarbamothioyl)sulfanyl]zinc
Traditional Nameziram
SMILESCN(C)C(=S)S[Zn]SC(=S)N(C)C
InChI IdentifierInChI=1S/2C3H7NS2.Zn/c2*1-4(2)3(5)6;/h2*1-2H3,(H,5,6);/q;;+2/p-2
InChI KeyDUBNHZYBDBBJHD-UHFFFAOYSA-L
Chemical Taxonomy
Description belongs to the class of organic compounds known as organic transition metal salts. These are organic salt compounds containing a transition metal atom in its ionic form.
KingdomOrganic compounds
Super ClassOrganic salts
ClassOrganic metal salts
Sub ClassOrganic transition metal salts
Direct ParentOrganic transition metal salts
Alternative Parents
Substituents
  • Organic transition metal salt
  • Organic nitrogen compound
  • Organopnictogen compound
  • Hydrocarbon derivative
  • Organosulfur compound
  • Organonitrogen compound
  • Aliphatic acyclic compound
Molecular FrameworkNot Available
External Descriptors
Biological Properties
StatusDetected and Not Quantified
OriginExogenous
Cellular Locations
  • Cytoplasm
  • Extracellular
Biofluid LocationsNot Available
Tissue LocationsNot Available
PathwaysNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Physical Properties
StateSolid
AppearanceWhite crystals.
Experimental Properties
PropertyValue
Melting Point250°C
Boiling PointNot Available
Solubility0.065 mg/mL at 25°C [GUNTHER,FA et al. (1968)]
Predicted Properties
PropertyValueSource
Water Solubility0.12 g/LALOGPS
logP1.86ALOGPS
logP1.74ChemAxon
logS-3.4ALOGPS
Physiological Charge0ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count0ChemAxon
Polar Surface Area6.48 ŲChemAxon
Rotatable Bond Count4ChemAxon
Refractivity69.24 m³·mol⁻¹ChemAxon
Polarizability26.56 ųChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterYesChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyView
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-0udi-0139000000-e6dfbc43c92ba0245ebeSpectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-000i-9100000000-c9631804bff9f34036cbSpectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-014r-9750000000-18a89bf261bf4687dd26Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-0udi-3119000000-93b3e9f8d240e91db696Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-0uy0-9625000000-08c5f6307170a4d62ca7Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-014r-7971000000-d0912a64c40ba4d2c93aSpectrum
MSMass Spectrum (Electron Ionization)splash10-0k9i-6539000000-4cf7031e44557fbc7ee3Spectrum
Toxicity Profile
Route of ExposureOral (3) ; inhalation (3) ; dermal (3)
Mechanism of ToxicityAnaemia results from the excessive absorption of zinc suppressing copper and iron absorption, most likely through competitive binding of intestinal mucosal cells. Unbalanced levels of copper and zinc binding to Cu,Zn-superoxide dismutase has been linked to amyotrophic lateral sclerosis (ALS). Stomach acid dissolves metallic zinc to give corrosive zinc chloride, which can cause damage to the stomach lining. Metal fume fever is thought to be an immune response to inhaled zinc. (2, 3, 1)
MetabolismZinc can enter the body through the lungs, skin, and gastrointestinal tract. Intestinal absorption of zinc is controlled by zinc carrier protein CRIP. Zinc also binds to metallothioneins, which help prevent absorption of excess zinc. Zinc is widely distributed and found in all tissues and tissues fluids, concentrating in the liver, gastrointestinal tract, kidney, skin, lung, brain, heart, and pancreas. In the bloodstream zinc is found bound to carbonic anhydrase in erythrocytes, as well as bound to albumin, _2-macroglobulin, and amino acids in the the plasma. Albumin and amino acid bound zinc can diffuse across tissue membranes. Zinc is excreted in the urine and faeces. (3)
Toxicity ValuesLD50: 18 mg/kg (Intravenous, Mouse) (7) LD50: 23 mg/kg (Intraperitoneal, Rat) (7) LD50: 320 mg/kg (Oral, Rat) (8) LC50: 81 mg/m3 over 4 hours (Inhalation, Rat) (7)
Lethal DoseNot Available
Carcinogenicity (IARC Classification)3, not classifiable as to its carcinogenicity to humans. (6)
Uses/SourcesThis is a man-made compound that is used as a pesticide.
Minimum Risk LevelIntermediate Oral: 0.3 mg/kg/day (5) Chronic Oral: 0.3 mg/kg/day (5)
Health EffectsChronic exposure to zinc causes anemia, atazia, lethargy, and decreases the level of good cholesterol in the body. It is also believed to cause pancreatic and reproductive damage. (3)
SymptomsIngestion of large doses of zinc causes stomach cramps, nausea, and vomiting. Acute inhalation of large amounts of zinc causes metal fume fever, which is characterized by chills, fever, headache, weakness, dryness of the nose and throat, chest pain, and coughing. Dermal contact with zinc results in skin irritation. (3)
TreatmentZinc poisoning is treated symptomatically, often by administering fluids such as water or milk, or with gastric lavage. (3)
Concentrations
Not Available
DrugBank IDNot Available
HMDB IDNot Available
FooDB IDNot Available
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkZiram
Chemspider IDNot Available
ChEBI ID79736
PubChem Compound ID8722
Kegg Compound IDC15229
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General References
1. https://www.ncbi.nlm.nih.gov/pubmed/?term=16007644
2. https://www.ncbi.nlm.nih.gov/pubmed/?term=1842586
3. https://www.ncbi.nlm.nih.gov/pubmed/?term=18818210
4. https://www.ncbi.nlm.nih.gov/pubmed/?term=20842346
5. https://www.ncbi.nlm.nih.gov/pubmed/?term=22159898
6. https://www.ncbi.nlm.nih.gov/pubmed/?term=23298479
7. https://www.ncbi.nlm.nih.gov/pubmed/?term=24750788
8. https://www.ncbi.nlm.nih.gov/pubmed/?term=8478981