1,3,4,6,7,9,9b-Heptaazaphenalene
2,4,6,8,10,12,13-heptazatricyclo[7.3.1.05,13]trideca-1(12),2,4,6,8,10-hexaene
Also Known As: tri-s-triazine|1,3,4,6,7,9,9b-Heptaazaphenalene|KST-1B1606|1,3,3A1,4,6,7,9-heptaazaphenalene|1,3,4,6,7,9,9b-Heptaaza-phenalene|1,3,4,6,7,9,9b-Heptaaza-9bH-phenalene|2,4,6,8,10,12,13-heptaazatricyclo[7.3.1.05,13]trideca-1,3,5,7,9,11-hexaene|2,4,6,8,10,12,13-heptazatricyclo[7.3.1.05,13]trideca-1(12),2,4,6,8,10-hexaene
| Molecular Formula | C6H3N7 |
|---|---|
| Molecular Weight | 173.045 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 77.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 0 |
| Exact Mass | 173.045 |
| Monoisotopic Mass | 173.045 |
| Heavy Atoms | 13 |
| Complexity | 333.0 |
Chemical Identifiers
| CAS Number | 2085-90-7 |
|---|---|
| SMILES | C1=NC2=NC=NC3=NC=NC(=N1)N23 |
| InChIKey | DKZXTOPFCDDGGX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,3,4,6,7,9,9b-Heptaazaphenalene (CAS 2085-90-7), with molecular formula C6H3N7 and molecular weight 173.045 g/mol. IUPAC: 2,4,6,8,10,12,13-heptazatricyclo[7.3.1.05,13]trideca-1(12),2,4,6,8,10-hexaene.
1,3,4,6,7,9,9b-Heptaazaphenalene is a custom synthesis product. We offer services from milligram to kilogram scale.
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