TL;DR: 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl hydrogen sulfate (CAS 1195292-70-6) is a chemical compound with molecular formula C10H19NO4S and molecular weight 249.10349 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl hydrogen sulfate
Also Known As: 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl hydrogen sulfate, 1-(sulfooxymethyl)-2,3,4,6,7,8,9,9a-octahydro-1H-quinolizine
| Molecular Formula | C10H19NO4S |
| Molecular Weight | 249.10349 g/mol |
| XLogP | -1.4 |
| Topological Polar Surface Area (TPSA) | 75.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.10349 Da |
| Heavy Atoms | 16 |
| Complexity | 324.0 |
| SMILES | C1CCN2CCCC(C2C1)COS(=O)(=O)O |
| InChIKey | CNAMMIWTQITTHV-UHFFFAOYSA-N |
The XLogP value of -1.4 indicates that 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl hydrogen sulfate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl hydrogen sulfate. Following Lipinski's Rule of Five, 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl hydrogen sulfate has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl hydrogen sulfate is 1195292-70-6.
The molecular formula of 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl hydrogen sulfate is C10H19NO4S.
The molecular weight of 2,3,4,6,7,8,9,9a-octahydro-1H-quinolizin-1-ylmethyl hydrogen sulfate is 249.10349 g/mol.
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