AC1O3OHS
ethyl 5-methyl-7-quinolin-1-ium-6-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate
Also Known As: ethyl 5-methyl-7-quinolin-1-ium-6-yl-1,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate|6-[6-(Ethoxycarbonyl)-5-methyl-1,7-dihydrotetrazolo[1,5-a]pyrimidin-7-yl]quinolin-1-ium|Ethyl 4-methyl-2-(1H-quinolin-6-yl)-1,5,7,8,9-pentazabicyclo[4.3.0]nona-3,5,7-triene-3-carboxylate
CAS: 6714-80-3
| Molecular Formula | C17H17N6O2+ |
|---|---|
| Molecular Weight | 337.1413 g/mol |
| LogP | 1.4924 |
| Topological Polar Surface Area | 96.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 337.1413 |
| Monoisotopic Mass | 337.1413 |
| Heavy Atoms | 25 |
| Complexity | 993.47656 |
Chemical Identifiers
| CAS Number | 6714-80-3 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC2=NN=NN2C1C3=CC4=C(C=C3)[NH+]=CC=C4)C |
Product Overview
AC1O3OHS (CAS 6714-80-3), with molecular formula C17H17N6O2+ and molecular weight 337.1413 g/mol. IUPAC: ethyl 5-methyl-7-quinolin-1-ium-6-yl-4,7-dihydrotetrazolo[1,5-a]pyrimidine-6-carboxylate.
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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