异喹啉-2-鎓-2-胺
TL;DR: 异喹啉-2-鎓-2-胺 (CAS 45882-18-6) is a chemical compound with molecular formula C9H9N2+ and molecular weight 145.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
异喹啉-2-鎓-2-胺
isoquinolin-2-ium-2-amine
Also Known As: 2-aminoisoquinolinium, Isoquinolin-2-amine, Isoquinolinium,2-amino-, 2-Aminoisoquinoline-2-ium, isoquinolin-2-ium-2-amine
| Molecular Formula | C9H9N2+ |
|---|---|
| Molecular Weight | 145.08 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 29.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 145.07657 |
| Heavy Atoms | 11 |
| Complexity | 136.0 |
Chemical Identifiers
| CAS Number | 45882-18-6 |
|---|---|
| SMILES | C1=CC=C2C=[N+](C=CC2=C1)N |
| InChIKey | VHCCINKZRHFLEQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
异喹啉-2-鎓-2-胺 (CAS 45882-18-6), with molecular formula C9H9N2+ and molecular weight 145.08 g/mol. IUPAC: isoquinolin-2-ium-2-amine.
Chemical Property Profile of 异喹啉-2-鎓-2-胺
Property Insights of 异喹啉-2-鎓-2-胺
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 异喹啉-2-鎓-2-胺. With a topological polar surface area (TPSA) of 29.9 Ų, 异喹啉-2-鎓-2-胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 异喹啉-2-鎓-2-胺 has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 异喹啉-2-鎓-2-胺?
The CAS number of 异喹啉-2-鎓-2-胺 is 45882-18-6.
What is the molecular formula of 异喹啉-2-鎓-2-胺?
The molecular formula of 异喹啉-2-鎓-2-胺 is C9H9N2+.
What is the molecular weight of 异喹啉-2-鎓-2-胺?
The molecular weight of 异喹啉-2-鎓-2-胺 is 145.08 g/mol.
Where can I buy 异喹啉-2-鎓-2-胺?
You can request a quote for 异喹啉-2-鎓-2-胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 异喹啉-2-鎓-2-胺?
Yes, KEHONG BIO provides custom synthesis services for 异喹啉-2-鎓-2-胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.