5,7-dimethyl-6H-1,4-diazepine-2,3-dicarbonitrile
5,7-dimethyl-6H-1,4-diazepine-2,3-dicarbonitrile
Also Known As: 5,7-dimethyl-6H-1,4-diazepine-2,3-dicarbonitrile|KS-00001V1F|2-T-BUTYLAMINO-4,5-DICYANOIMIDAZOLE|J1.543.228D|2,3-dicyano-5,7-dimethyl-6H-1,4-diazepine|2W-0285
CAS: 51802-55-2
| Molecular Formula | C9H8N4 |
|---|---|
| Molecular Weight | 172.07489 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 72.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 172.07489 |
| Monoisotopic Mass | 172.07489 |
| Heavy Atoms | 13 |
| Complexity | 379.0 |
Chemical Identifiers
| CAS Number | 51802-55-2 |
|---|---|
| SMILES | CC1=NC(=C(N=C(C1)C)C#N)C#N |
| InChIKey | MAFHEXKPIODQPC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Heterocyclic Building Blocks (4 patents)
Product Overview
5,7-dimethyl-6H-1,4-diazepine-2,3-dicarbonitrile (CAS 51802-55-2), with molecular formula C9H8N4 and molecular weight 172.07489 g/mol. IUPAC: 5,7-dimethyl-6H-1,4-diazepine-2,3-dicarbonitrile.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
View MSDS →
5,7-dimethyl-6H-1,4-diazepine-2,3-dicarbonitrile is a custom synthesis product. We offer services from milligram to kilogram scale.
Request a Quote »