(3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate
TL;DR: (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate (CAS 128502-56-7) is a chemical compound with molecular formula C10H11NO3 and molecular weight 193.0739 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate
Also Known As: (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate, (3S)-7-oxidanyl-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate
Technical Specifications
| Molecular Formula | C10H11NO3 |
| Molecular Weight | 193.0739 g/mol |
| XLogP | -1.7 |
| Topological Polar Surface Area (TPSA) | 69.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 193.0739 Da |
| Heavy Atoms | 14 |
| Complexity | 231.0 |
| SMILES | C1[C@H]([NH2+]CC2=C1C=CC(=C2)O)C(=O)[O-] |
| InChIKey | HIKCRLDSCSWXML-VIFPVBQESA-N |
Chemical Property Profile of (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate
Property Insights of (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate
The XLogP value of -1.7 indicates that (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 69.6 Ų falls within the moderate polarity range, balancing permeability and solubility for (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate. Following Lipinski's Rule of Five, (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate?
The CAS number of (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate is 128502-56-7.
What is the molecular formula of (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate?
The molecular formula of (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate is C10H11NO3.
What is the molecular weight of (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate?
The molecular weight of (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate is 193.0739 g/mol.
Where can I buy (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate?
You can request a quote for (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate?
Yes, CoreyChem provides custom synthesis services for (3S)-7-hydroxy-1,2,3,4-tetrahydroisoquinolin-2-ium-3-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.