5,6-Bis(4-methylphenyl)pyrazine-2,3-dicarbonitrile
Basic information
- CAS
52197-13-4- Standard SMILES
Cc1ccc(-c2nc(C#N)c(C#N)nc2-c2ccc(C)cc2)cc1- InChIKey
QLLCOQJZXYRKSF-UHFFFAOYSA-N- Molecular formula
- C20H14N4
- Average molar mass
- 310.4 g/mol
- Monoisotopic mass
- 310.12184646
Names & identifiers
- Preferred name
- 5,6-Bis(4-methylphenyl)pyrazine-2,3-dicarbonitrile
- IUPAC
- 5,6-bis(4-methylphenyl)pyrazine-2,3-dicarbonitrile
Names & synonyms
52197-13-45,6-Di-p-tolylpyrazine-2,3-dicarbonitrile5,6-bis(4-methylphenyl)pyrazine-2,3-dicarbonitrileNSC174794SCHEMBL2681245DTXSID50306261NSC-174794
Database identifiers
- CAS
52197-13-4- PubChem CID
- 300415
- DTXSID
DTXSID50306261
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 73.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 462
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Compound notes
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