Nabam (CHEM004204)

IdentificationTaxonomyBiological PropertiesPhysical PropertiesToxicity ProfileSpectraConcentrationsLinksReferencesXML
Record Information
Version1.0
Creation Date2016-05-19 01:37:22 UTC
Update Date2016-11-09 01:09:18 UTC
Accession NumberCHEM004204
Identification
Common NameNabam
ClassSmall Molecule
DescriptionA dithiocarbamate salt that is the disodium salt of ethylenebis(dithiocarbamic acid). A fungicide, algicide and bactericide used on various crops including on cotton, capsicums, onions and rice crops, it is considered to be a carcinogen, so is not licensed for use within the European Union. Mixing nabam with zinc sulfate affords the fungicide zineb.
Contaminant Sources
  • Clean Air Act Chemicals
  • EAFUS Chemicals
  • FooDB Chemicals
  • HPV EPA Chemicals
  • ToxCast & Tox21 Chemicals
Contaminant TypeNot Available
Chemical Structure
Thumb
MOLSDFPDBSMILESInChI
Synonyms
ValueSource
1,2-Ethanediylbiscarbamodithioic acid disodium saltChEBI
Di-natrium-aethylenbisdithiocarbamatChEBI
Dinatrium-(N,n'-aethylen-bis(dithiocarbamat))ChEBI
Disodium ethylene-1,2-bisdithiocarbamateChEBI
Disodium ethylenebis(dithiocarbamate)ChEBI
Disodium N,n'-1,2-ethanediylbis(carbamodithioate)ChEBI
Disodium N,n'-ethane-1,2-diyldicarbamodithioateChEBI
Dithane a-40ChEBI
N,N'-ethylene bis(dithiocarbamate de sodium)ChEBI
NabameChEBI
ParzateChEBI
Sodium ethylenebis(dithiocarbamate)ChEBI
Spring-bakChEBI
1,2-Ethanediylbiscarbamodithioate disodium saltGenerator
Disodium ethylene-1,2-bisdithiocarbamic acidGenerator
Disodium ethylenebis(dithiocarbamic acid)Generator
Disodium N,n'-1,2-ethanediylbis(carbamodithioic acid)Generator
Disodium N,n'-ethane-1,2-diyldicarbamodithioic acidGenerator
N,N'-ethylene bis(dithiocarbamic acid de sodium)Generator
Parzic acidGenerator
Sodium ethylenebis(dithiocarbamic acid)Generator
AmobamHMDB
Carbamic acid, ethylenebis(dithio-, disodium saltHMDB
Carbamodithioic acid, 1,2-ethanediylbis-, disodiumHMDB
Carbamodithioic acid, 1,2-ethanediylbis-, disodium saltHMDB
Chem bamHMDB
Dinatrium-(N,n'-ethyleen-bis(dithiocarbamaat))HMDB
Disodium 1,2-ethanediylbis (carbamodithioate)HMDB
Disodium ethane-1,2-diylbis(dithiocarbamate)HMDB
Disodium ethylenebisdithiocarbamateHMDB
Dithane a40HMDB
Dithane D-14HMDB
Dithane D-14 (discontinued)HMDB
Dithiane D-14HMDB
DSEHMDB
Ebdc, disodium saltHMDB
Ethylen-bis-dithiokarbaman sodnyHMDB
Ethylenebis(dithiocarbamate) sodiumHMDB
Ethylenebis(dithiocarbamate), disodium saltHMDB
Ethylenebis(dithiocarbamic acid) disodium saltHMDB
Ethylenebisdithiocarbamate, disodiumHMDB
N,N'-etilen-bis(ditiocarbammato) di sodioHMDB
Nabam, ammonium saltHMDB
Nabam, bsi, isoHMDB
Nabam, calcium salt (1:1)HMDB
Nabam, diammonium saltHMDB
Nabam, dipotassium saltHMDB
Nabam, disodium saltHMDB
Nabam, iron saltHMDB
Nabam, potassium saltHMDB
Nabam, sodium saltHMDB
NabasanHMDB
Nafun ipoHMDB
Parzate liquidHMDB
X-SporHMDB
Chemical FormulaC4H6N2Na2S4
Average Molecular Mass256.343 g/mol
Monoisotopic Mass255.921 g/mol
CAS Registry Number142-59-6
IUPAC Namedisodium ({2-[(sulfanidylmethanethioyl)amino]ethyl}carbamothioyl)sulfanide
Traditional Namedisodium ({2-[(sulfanidylmethanethioyl)amino]ethyl}carbamothioyl)sulfanide
SMILES[Na+].[Na+].[S-]C(=S)NCCNC([S-])=S
InChI IdentifierInChI=1S/C4H8N2S4.2Na/c7-3(8)5-1-2-6-4(9)10;;/h1-2H2,(H2,5,7,8)(H2,6,9,10);;/q;2*+1/p-2
InChI KeyUQJQVUOTMVCFHX-UHFFFAOYSA-L
Chemical Taxonomy
Description belongs to the class of organic compounds known as organic alkali metal salts. These are organic salts of an alkali metal. The alkali metal atom is usually in its ionic form.
KingdomOrganic compounds
Super ClassOrganic salts
ClassOrganic metal salts
Sub ClassOrganic alkali metal salts
Direct ParentOrganic alkali metal salts
Alternative Parents
Substituents
  • Organic alkali metal salt
  • Organic 1,3-dipolar compound
  • Propargyl-type 1,3-dipolar organic compound
  • Organic nitrogen compound
  • Organopnictogen compound
  • Hydrocarbon derivative
  • Organic sodium salt
  • Organosulfur compound
  • Organonitrogen compound
  • Aliphatic acyclic compound
Molecular FrameworkAliphatic acyclic compounds
External Descriptors
Biological Properties
StatusDetected and Not Quantified
OriginNot Available
Cellular LocationsNot Available
Biofluid LocationsNot Available
Tissue LocationsNot Available
PathwaysNot Available
ApplicationsNot Available
Biological RolesNot Available
Chemical RolesNot Available
Physical Properties
StateNot Available
AppearanceNot Available
Experimental Properties
PropertyValue
Melting PointNot Available
Boiling PointNot Available
SolubilityNot Available
Predicted Properties
PropertyValueSource
Water Solubility0.12 g/LALOGPS
logP0.59ALOGPS
logP1.97ChemAxon
logS-3.3ALOGPS
pKa (Strongest Acidic)1.74ChemAxon
Physiological Charge-2ChemAxon
Hydrogen Acceptor Count0ChemAxon
Hydrogen Donor Count2ChemAxon
Polar Surface Area24.06 ŲChemAxon
Rotatable Bond Count3ChemAxon
Refractivity60.76 m³·mol⁻¹ChemAxon
Polarizability20.94 ųChemAxon
Number of Rings0ChemAxon
Bioavailability1ChemAxon
Rule of FiveYesChemAxon
Ghose FilterNoChemAxon
Veber's RuleYesChemAxon
MDDR-like RuleNoChemAxon
Spectra
Spectra
Spectrum TypeDescriptionSplash KeyView
Predicted GC-MSPredicted GC-MS Spectrum - GC-MS (Non-derivatized) - 70eV, Positivesplash10-004i-7900000000-7c1cffaeb5d7a4c6cc95Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Positivesplash10-0a4i-3190000000-493d02df2322a17f4453Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Positivesplash10-0a4i-1790000000-11abdc66a716323b9eacSpectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Positivesplash10-0002-9100000000-9b11c8495ac5a2747256Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 10V, Negativesplash10-0udi-0090000000-d90fb688c5d69b45c694Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 20V, Negativesplash10-0udi-0090000000-d90fb688c5d69b45c694Spectrum
Predicted LC-MS/MSPredicted LC-MS/MS Spectrum - 40V, Negativesplash10-0udi-0090000000-d90fb688c5d69b45c694Spectrum
Toxicity Profile
Route of ExposureNot Available
Mechanism of ToxicityNot Available
MetabolismNot Available
Toxicity ValuesNot Available
Lethal DoseNot Available
Carcinogenicity (IARC Classification)Not Available
Uses/SourcesNot Available
Minimum Risk LevelNot Available
Health EffectsNot Available
SymptomsNot Available
TreatmentNot Available
Concentrations
Not Available
DrugBank IDNot Available
HMDB IDHMDB0031224
FooDB IDFDB003248
Phenol Explorer IDNot Available
KNApSAcK IDNot Available
BiGG IDNot Available
BioCyc IDNot Available
METLIN IDNot Available
PDB IDNot Available
Wikipedia LinkNot Available
Chemspider IDNot Available
ChEBI ID81934
PubChem Compound ID8891
Kegg Compound IDC18748
YMDB IDNot Available
ECMDB IDNot Available
References
Synthesis ReferenceNot Available
MSDSNot Available
General References
1. https://www.ncbi.nlm.nih.gov/pubmed/?term=1161698
2. https://www.ncbi.nlm.nih.gov/pubmed/?term=17797593
3. https://www.ncbi.nlm.nih.gov/pubmed/?term=18966479
4. https://www.ncbi.nlm.nih.gov/pubmed/?term=1904852
5. https://www.ncbi.nlm.nih.gov/pubmed/?term=1929852
6. https://www.ncbi.nlm.nih.gov/pubmed/?term=23799268