p-Benzenedimalononitrile
2-[4-(dicyanomethyl)phenyl]propanedinitrile
Also Known As: p-Benzenedimalononitrile|Tetracyano-p-xylene|2,2'-(1,4-Phenylene)dimalononitrile|p-phenylenedimalononitrile|2-[4-(dicyanomethyl)phenyl]propanedinitrile|1,4-Bis(dicyanomethyl)benzene|1,4-Phenylenebis(malononitrile)|AC8233|2,2'-benzene-1,4-diyldipropanedinitrile|2,2-benzene-1,4-diyldipropanedinitrile|2,2'-(1,4-Phenylene)dipropanedinitrile|2,2 -(1,4-Phenylene)bis(malononitrile)|2,2?-(1,4-PHENYLENE)DIMALONONITRILE|2,2 inverted exclamation mark -(1,4-Phenylene)dimalononitrile
| Molecular Formula | C12H6N4 |
|---|---|
| Molecular Weight | 206.05925 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 95.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 206.05925 |
| Monoisotopic Mass | 206.05925 |
| Heavy Atoms | 16 |
| Complexity | 358.0 |
Chemical Identifiers
| CAS Number | 1874-85-7 |
|---|---|
| SMILES | C1=CC(=CC=C1C(C#N)C#N)C(C#N)C#N |
| InChIKey | WASJFLRMRDGSBD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
p-Benzenedimalononitrile (CAS 1874-85-7), with molecular formula C12H6N4 and molecular weight 206.05925 g/mol. IUPAC: 2-[4-(dicyanomethyl)phenyl]propanedinitrile.
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