Diploceline
methyl 2-(3-ethylidene-5-methyl-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-5-ium-2-yl)-3-hydroxypropanoate
Also Known As: Diploceline|methyl 2-(3-ethylidene-5-methyl-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-5-ium-2-yl)-3-hydroxypropanoate
CAS: 69306-89-4
| Molecular Formula | C22H29N2O3+ |
|---|---|
| Molecular Weight | 369.2178 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 62.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 369.2178 |
| Monoisotopic Mass | 369.2178 |
| Heavy Atoms | 27 |
| Complexity | 606.0 |
Chemical Identifiers
| CAS Number | 69306-89-4 |
|---|---|
| SMILES | CC=C1C[N+]2(CCC3=C(C2CC1C(CO)C(=O)OC)NC4=CC=CC=C34)C |
| InChIKey | MOOPNKBUQLUWAB-UHFFFAOYSA-N |
Product Overview
Diploceline (CAS 69306-89-4), with molecular formula C22H29N2O3+ and molecular weight 369.2178 g/mol. IUPAC: methyl 2-(3-ethylidene-5-methyl-2,4,6,7,12,12b-hexahydro-1H-indolo[2,3-a]quinolizin-5-ium-2-yl)-3-hydroxypropanoate.
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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