5,8-Dimethyl-2-oxidoisoquinolin-2-ium
TL;DR: 5,8-Dimethyl-2-oxidoisoquinolin-2-ium (CAS 155826-17-8) is a chemical compound with molecular formula C11H11NO and molecular weight 173.08406 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,8-dimethyl-2-oxidoisoquinolin-2-ium
Also Known As: 5,8-dimethylisoquinoline-N-oxide, 5,8-dimethylisoquinoline 2-oxide, 5,8-dimethyl-2-oxidoisoquinolin-2-ium
Technical Specifications
| Molecular Formula | C11H11NO |
| Molecular Weight | 173.08406 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 25.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 173.08406 Da |
| Heavy Atoms | 13 |
| Complexity | 183.0 |
| SMILES | CC1=C2C=C[N+](=CC2=C(C=C1)C)[O-] |
| InChIKey | JSZZWJXWYRNLJF-UHFFFAOYSA-N |
Chemical Property Profile of 5,8-Dimethyl-2-oxidoisoquinolin-2-ium
Property Insights of 5,8-Dimethyl-2-oxidoisoquinolin-2-ium
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,8-Dimethyl-2-oxidoisoquinolin-2-ium. With a topological polar surface area (TPSA) of 25.5 Ų, 5,8-Dimethyl-2-oxidoisoquinolin-2-ium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,8-Dimethyl-2-oxidoisoquinolin-2-ium has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 5,8-Dimethyl-2-oxidoisoquinolin-2-ium?
The CAS number of 5,8-Dimethyl-2-oxidoisoquinolin-2-ium is 155826-17-8.
What is the molecular formula of 5,8-Dimethyl-2-oxidoisoquinolin-2-ium?
The molecular formula of 5,8-Dimethyl-2-oxidoisoquinolin-2-ium is C11H11NO.
What is the molecular weight of 5,8-Dimethyl-2-oxidoisoquinolin-2-ium?
The molecular weight of 5,8-Dimethyl-2-oxidoisoquinolin-2-ium is 173.08406 g/mol.
Where can I buy 5,8-Dimethyl-2-oxidoisoquinolin-2-ium?
You can request a quote for 5,8-Dimethyl-2-oxidoisoquinolin-2-ium directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 5,8-Dimethyl-2-oxidoisoquinolin-2-ium?
Yes, CoreyChem provides custom synthesis services for 5,8-Dimethyl-2-oxidoisoquinolin-2-ium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.