TL;DR: 1,2,3,4-Tetrahydroquinoline-6,8-dicarboxylic acid (CAS 123297-00-7) is a chemical compound with molecular formula C11H11NO4 and molecular weight 221.0688 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,2,3,4-tetrahydroquinoline-6,8-dicarboxylic acid
Also Known As: 1,2,3,4-tetrahydroquinoline-6,8-dicarboxylic Acid, 6,8-Quinolinedicarboxylic acid, 1,2,3,4-tetrahydro-
| Molecular Formula | C11H11NO4 |
| Molecular Weight | 221.0688 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 221.0688 Da |
| Heavy Atoms | 16 |
| Complexity | 304.0 |
| SMILES | C1CC2=C(C(=CC(=C2)C(=O)O)C(=O)O)NC1 |
| InChIKey | PWZIJJJYBPBFAP-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,4-Tetrahydroquinoline-6,8-dicarboxylic acid. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2,3,4-Tetrahydroquinoline-6,8-dicarboxylic acid. Following Lipinski's Rule of Five, 1,2,3,4-Tetrahydroquinoline-6,8-dicarboxylic acid has 3 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 1,2,3,4-Tetrahydroquinoline-6,8-dicarboxylic acid is 123297-00-7.
The molecular formula of 1,2,3,4-Tetrahydroquinoline-6,8-dicarboxylic acid is C11H11NO4.
The molecular weight of 1,2,3,4-Tetrahydroquinoline-6,8-dicarboxylic acid is 221.0688 g/mol.
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