chempirical

Potassium dimethyldithiocarbamate

C3H6KNS2CAS 128-03-0159.31 g/mol

Open in Covalent MOL file
NS−SK+
Thiol

Properties

Molecular formula
C3H6KNS2
Molar mass
159.31 g/mol
Exact mass
158.9579 Da
logP
0.38Crippen estimate
Polar surface area
3.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
128-03-0
SMILES
CN(C)C([S-])=S.[K+]
InChIKey
CCPXJWCBSIZVGZ-UHFFFAOYSA-N
InChI
InChI=1S/C3H7NS2.K/c1-4(2)3(5)6;/h1-2H3,(H,5,6);

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Names and synonyms

7 names
  • Carbamodithioic acid, N,N-dimethyl-, potassium salt (1:1)
  • Carbamic acid, dimethyldithio-, potassium salt
  • Carbamodithioic acid, dimethyl-, potassium salt
  • Potassium N,N-dimethyldithiocarbamate
  • Busan 85
  • Arylane
  • MBC 350

Work with Potassium dimethyldithiocarbamate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Sodium dimethyldithiocarbamate128-04-171 % similar Copper dimethyldithiocarbamate137-29-171 % similar Zinc bis(dimethyldithiocarbamate)137-30-471 % similar Nickel bis(dimethyldithiocarbamate)14484-64-171 % similar Nickel dimethyldithiocarbamate15521-65-071 % similar Tetramethylthiourea2782-91-436 % similar Cadmium diethyldithiocarbamate14239-68-034 % similar Zinc diethyldithiocarbamate14324-55-134 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia