Isoquinolinium, 2-hexyl-
TL;DR: Isoquinolinium, 2-hexyl- (CAS 89965-26-4) is a chemical compound with molecular formula C15H20N+ and molecular weight 214.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-hexylisoquinolin-2-ium
Also Known As: 2-hexylisoquinolin-2-ium, Isoquinolinium, 2-hexyl-, 2-Hexylisoquinolinium, Isoquinolinium,2-hexyl, 2-Hexylisoquinoline-2-ium
| Molecular Formula | C15H20N+ |
|---|---|
| Molecular Weight | 214.16 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 3.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 5 |
| Exact Mass | 214.15958 |
| Heavy Atoms | 16 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 89965-26-4 |
|---|---|
| SMILES | CCCCCC[N+]1=CC2=CC=CC=C2C=C1 |
| InChIKey | RQLZZCGLNJCDEK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Isoquinolinium, 2-hexyl- (CAS 89965-26-4), with molecular formula C15H20N+ and molecular weight 214.16 g/mol. IUPAC: 2-hexylisoquinolin-2-ium.
Chemical Property Profile of Isoquinolinium, 2-hexyl-
Property Insights of Isoquinolinium, 2-hexyl-
The XLogP value of 3.6 indicates that Isoquinolinium, 2-hexyl- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.9 Ų, Isoquinolinium, 2-hexyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinolinium, 2-hexyl- has 0 hydrogen bond donor(s) and 0 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 Isoquinolinium, 2-hexyl-?
The CAS number of Isoquinolinium, 2-hexyl- is 89965-26-4.
What is the molecular formula of Isoquinolinium, 2-hexyl-?
The molecular formula of Isoquinolinium, 2-hexyl- is C15H20N+.
What is the molecular weight of Isoquinolinium, 2-hexyl-?
The molecular weight of Isoquinolinium, 2-hexyl- is 214.16 g/mol.
Where can I buy Isoquinolinium, 2-hexyl-?
You can request a quote for Isoquinolinium, 2-hexyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinolinium, 2-hexyl-?
Yes, KEHONG BIO provides custom synthesis services for Isoquinolinium, 2-hexyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.