2-(Pyren-1-ylmethylidene)propanedinitrile
2-(pyren-1-ylmethylidene)propanedinitrile
Also Known As: 1-dicyanovinylpyrene|(pyren-1-ylmethylene)malononitrile|2-(pyren-1-ylmethylidene)propanedinitrile|starbld0009161|1-Pyrenylmethylenemalononitrile|2-(Pyren-1-ylmethylene)malononitrile|(1-Pyrenylmethylene)malononitrile|KST-1A3379|2-(1-Pyrenylmethylene)malononitrile|2-((1-Pyrenyl)methylene)malonitrile|[(Pyrene-1-yl)methylene]malononitrile|2-(Pyrene-1-ylmethylene)malononitrile|(pyren-1-ylmethylidene)propanedinitrile|2-(pyren-1-ylmethylene)propanedinitrile|2-[(pyren-1-yl)methylidene]propanedinitrile|[(Pyren-1-yl)methylidene]propanedinitrile|Propanedinitrile,2-(1-pyrenylmethylene)-|J1.214.706F
| Molecular Formula | C20H10N2 |
|---|---|
| Molecular Weight | 278.0844 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 47.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 278.0844 |
| Monoisotopic Mass | 278.0844 |
| Heavy Atoms | 22 |
| Complexity | 553.0 |
Chemical Identifiers
| CAS Number | 274-49-7 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C=C(C#N)C#N |
| InChIKey | KQRUQVGUIFJRBU-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Pyren-1-ylmethylidene)propanedinitrile (CAS 274-49-7), with molecular formula C20H10N2 and molecular weight 278.0844 g/mol. IUPAC: 2-(pyren-1-ylmethylidene)propanedinitrile.