chempirical

2,3-Dicyanopyrazine

C6H2N4CAS 13481-25-9130.11 g/mol

Open in Covalent MOL file
NNNN
Nitrile

Properties

Molecular formula
C6H2N4
Molar mass
130.11 g/mol
Exact mass
130.0279 Da
logP
0.22Crippen estimate
Polar surface area
73.4 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
0

Identifiers

CAS number
13481-25-9
SMILES
C1=CN=C(C(=N1)C#N)C#N
InChIKey
OTVZGAXESBAAQQ-UHFFFAOYSA-N
InChI
InChI=1S/C6H2N4/c7-3-5-6(4-8)10-2-1-9-5/h1-2H

Weigh it out

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

Work with 2,3-Dicyanopyrazine

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

3-Methyl-2-pyridinecarbonitrile20970-75-650 % similar 3-Hydroxy-2-pyridinecarbonitrile932-35-450 % similar Pyrazinecarbonitrile19847-12-246 % similar 2-Pyrimidinecarbonitrile14080-23-045 % similar 4-Amino-5-cyanoimidazole5098-11-342 % similar 1H-1,2,4-Triazole-5-carbonitrile3641-10-940 % similar 1H-Imidazole-5-carbonitrile57090-88-740 % similar 4-Chloro-2-cyanopyridine19235-89-339 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook