chempirical

5,6-Dichloro-2,3-dicyanopyrazine

C6Cl2N4CAS 56413-95-7198.99 g/mol

Open in Covalent MOL file
NNNClClN
Aryl halideNitrile

Properties

Molecular formula
C6Cl2N4
Molar mass
198.99 g/mol
Exact mass
197.9500 Da
logP
1.53Crippen estimate
Polar surface area
73.4 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
56413-95-7
SMILES
C(#N)C1=C(N=C(C(=N1)Cl)Cl)C#N
InChIKey
QUFXYBKGILUJHS-UHFFFAOYSA-N
InChI
InChI=1S/C6Cl2N4/c7-5-6(8)12-4(2-10)3(1-9)11-5

Weigh it out

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

Work with 5,6-Dichloro-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

Hexaazatriphenylenehexacabonitrile105598-27-455 % similar 3-Chloropyrazine-2-carbonitrile55557-52-352 % similar 3,5-Dichloro-2-pyrazinecarbonitrile313339-92-350 % similar 3,6-Dichloropyrazine-2-carbonitrile356783-16-950 % similar 3-Bromo-5-chloro-6-ethylpyrazine-2-carbonitrile2043020-03-542 % similar 4,6-Dichloropyrimidine-5-carbonitrile5305-45-342 % similar 2,6-Pyridinedicarbonitrile2893-33-642 % similar 2,4-Dichloro-5-cyanopyrimidine3177-24-041 % similar

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

Elsewhere

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