chempirical

2,1,3-Benzoselenadiazole

C6H4N2SeCAS 273-15-4183.08 g/mol

Open in Covalent MOL file
NSeN

Properties

Molecular formula
C6H4N2Se
Molar mass
183.08 g/mol
Exact mass
183.9540 Da
Melting point
75 °C
logP
0.69Crippen estimate
Polar surface area
25.8 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
0

Identifiers

CAS number
273-15-4
SMILES
c1ccc2n[se]nc2c1
InChIKey
AYTPIVIDHMVGSX-UHFFFAOYSA-N
InChI
InChI=1S/C6H4N2Se/c1-2-4-6-5(3-1)7-9-8-6/h1-4H

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

7 names
  • Phenylpiazselenole
  • Piaselenole
  • Piazselenol
  • Piazselenole
  • 2-Selena-1,3-diaza-2H-isoindene
  • 3,4-Benzo-1,2,5-selenadiazole
  • NSC 408467

Work with 2,1,3-Benzoselenadiazole

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

Phenazine92-82-047 % similar Quinoxaline91-19-042 % similar Benzo(C)cinnoline230-17-140 % similar 2,1,3-Benzoxadiazole273-09-640 % similar 2,1,3-Benzothiadiazole273-13-240 % similar 2,3-Dichloroquinoxaline2213-63-036 % similar 2,3-Dimethylquinoxaline2379-55-736 % similar Acridine260-94-636 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook