Akagerine
2-(9-hydroxy-4-methyl-4,10-diazatetracyclo[8.6.1.05,17.011,16]heptadeca-1(17),11,13,15-tetraen-7-yl)but-2-enal
Also Known As: Akagerine|(alphaE)-alpha-Ethylidene-1,2,3,3aalpha,4,5,6,7-octahydro-7alpha-hydroxy-3-methyl-3,7a-diazacyclohepta[jk]fluorene-5beta-acetaldehyde
CAS: 56519-07-4
| Molecular Formula | C20H24N2O2 |
|---|---|
| Molecular Weight | 324.18378 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 45.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 324.18378 |
| Monoisotopic Mass | 324.18378 |
| Heavy Atoms | 24 |
| Complexity | 520.0 |
Chemical Identifiers
| CAS Number | 56519-07-4 |
|---|---|
| SMILES | CC=C(C=O)C1CC2C3=C(CCN2C)C4=CC=CC=C4N3C(C1)O |
| InChIKey | LGSDYQBPJKYJCT-UHFFFAOYSA-N |
Product Overview
Akagerine (CAS 56519-07-4), with molecular formula C20H24N2O2 and molecular weight 324.18378 g/mol. IUPAC: 2-(9-hydroxy-4-methyl-4,10-diazatetracyclo[8.6.1.05,17.011,16]heptadeca-1(17),11,13,15-tetraen-7-yl)but-2-enal.
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 →
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