chempirical

Pyridazine-3-carbonitrile

C5H3N3CAS 53896-49-4105.10 g/mol

Open in Covalent MOL file
NNN
Nitrile

Properties

Molecular formula
C5H3N3
Molar mass
105.10 g/mol
Exact mass
105.0327 Da
logP
0.35Crippen estimate
Polar surface area
49.6 Ų
H-bond donors / acceptors
0 / 3
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
53896-49-4
SMILES
C1=CC(=NN=C1)C#N
InChIKey
PJESVVYWPFAJCS-UHFFFAOYSA-N
InChI
InChI=1S/C5H3N3/c6-4-5-2-1-3-7-8-5/h1-3H

Weigh it out

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Work with Pyridazine-3-carbonitrile

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

2-Cyanopyridine100-70-954 % similar 2,6-Pyridinedicarbonitrile2893-33-652 % similar 6,6'-Dicyano-2,2'-bipyridyl4411-83-046 % similar 6-Bromopyridine-2-carbonitrile122918-25-643 % similar 6-Chloro-2-pyridinecarbonitrile33252-29-843 % similar 6-Chloro-3-pyridazinecarbonitrile35857-89-743 % similar 6-Methylpyridine-2-carbonitrile1620-75-342 % similar 2-Pyridinecarbonitrile,6-amino-(9ci)370556-44-842 % similar

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

Same formula

2-Pyrimidinecarbonitrile14080-23-0 Pyrazinecarbonitrile19847-12-2 5-Cyanopyrimidine40805-79-6 4-Pyridazinecarbonitrile68776-62-5

Elsewhere

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