(5R,9aR)-7-(dithiophen-2-ylmethylidene)-5-methyl-1,2,3,4,6,8,9,9a-octahydroquinolizin-5-ium
(5R,9aR)-7-(dithiophen-2-ylmethylidene)-5-methyl-1,2,3,4,6,8,9,9a-octahydroquinolizin-5-ium
| Molecular Formula | C19H24NS2+ |
|---|---|
| Molecular Weight | 330.5 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 56.5 A2 |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 330.135 |
| Heavy Atoms | 22 |
| Complexity | 429.0 |
Chemical Identifiers
| CAS Number | 149755-23-7 |
|---|---|
| SMILES | C[N+]12CCCCC1CCC(=C(C3=CC=CS3)C4=CC=CS4)C2 |
| InChIKey | ZGSDGGRVFIYKKE-OXQOHEQNSA-N |
📖 Product Overview
(5R,9aR)-7-(dithiophen-2-ylmethylidene)-5-methyl-1,2,3,4,6,8,9,9a-octahydroquinolizin-5-ium (CAS: 149755-23-7) is a chemical compound with molecular formula C19H24NS2+ and molecular weight 330.5 g/mol. Its IUPAC systematic name is (5R,9aR)-7-(dithiophen-2-ylmethylidene)-5-methyl-1,2,3,4,6,8,9,9a-octahydroquinolizin-5-ium.
ZGSDGGRVFIYKKE-OXQOHEQNSA-N.
SMILES: C[N+]12CCCCC1CCC(=C(C3=CC=CS3)C4=CC=CS4)C2.
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