C1=CN=C(C=N1)C#N
CAS: 19847-12-2
Name: pyrazine-2-carbonitrile
SMILES: C1=CN=C(C=N1)C#N

Molecular Processing

Molecular formula
C5H3N3
Molecular weight
105.1
Exact mass
105.0327
XLogP
0.35
TPSA
49.57
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
8
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
26.75

Supplementary Information

InChIKey: PMSVVUSIPKHUMT-UHFFFAOYSA-N
Synonyms
Pyrazinecarbonitrile19847-12-22-CyanopyrazineCyanopyrazinePyrazinenitrilePyrazinonitrileNSC-7237174CP756B49NSC-166137CHEBI:3982DTXSID9066540RefChem:470759DTXCID6036174243-369-5Pyrazine-2-carbonitrile2-PyrazinecarbonitrileMFCD00049361Pyrazinecarbonitrile-EINECS 243-369-5PncA Inhibitor, 6NSC 166137Pyrazinamide Impurity B2-Pyrazine carbonitrilePyrazinamide Impurity 2PYRAZINYL CYANIDEPyrazinecarbonitrile, 99%NCIOpen2_000422SCHEMBL135948SCHEMBL151926SCHEMBL445395
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Involved in 63 reactions→

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