Isoquinolinium, 2-ethyl-, iodide
TL;DR: Isoquinolinium, 2-ethyl-, iodide (CAS 53854-49-2) is a chemical compound with molecular formula C11H12IN and molecular weight 285.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylisoquinolin-2-ium iodide
Also Known As: Isoquinolinium, 2-ethyl-, iodide, 2-ethylisoquinoline Iodide, 2-ethylisoquinolin-2-ium iodide, N-ethylisoquinolinium iodide, 2-Aethyl-isochinolinium,Jodid
| Molecular Formula | C11H12IN |
|---|---|
| Molecular Weight | 285.00 g/mol |
| LogP | -0.8488 |
| Topological Polar Surface Area | 3.88 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 0 |
| Rotatable Bonds | 1 |
| Exact Mass | 285.00146 |
| Heavy Atoms | 13 |
| Complexity | 397.96735 |
Chemical Identifiers
| CAS Number | 53854-49-2 |
|---|---|
| SMILES | CC[N+]1=CC2=CC=CC=C2C=C1.[I-] |
Product Overview
Isoquinolinium, 2-ethyl-, iodide (CAS 53854-49-2), with molecular formula C11H12IN and molecular weight 285.00 g/mol. IUPAC: 2-ethylisoquinolin-2-ium iodide.
Chemical Property Profile of Isoquinolinium, 2-ethyl-, iodide
Property Insights of Isoquinolinium, 2-ethyl-, iodide
The XLogP value of -0.8488 indicates that Isoquinolinium, 2-ethyl-, iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 3.88 Ų, Isoquinolinium, 2-ethyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isoquinolinium, 2-ethyl-, iodide 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-ethyl-, iodide?
The CAS number of Isoquinolinium, 2-ethyl-, iodide is 53854-49-2.
What is the molecular formula of Isoquinolinium, 2-ethyl-, iodide?
The molecular formula of Isoquinolinium, 2-ethyl-, iodide is C11H12IN.
What is the molecular weight of Isoquinolinium, 2-ethyl-, iodide?
The molecular weight of Isoquinolinium, 2-ethyl-, iodide is 285.00 g/mol.
Where can I buy Isoquinolinium, 2-ethyl-, iodide?
You can request a quote for Isoquinolinium, 2-ethyl-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Isoquinolinium, 2-ethyl-, iodide?
Yes, KEHONG BIO provides custom synthesis services for Isoquinolinium, 2-ethyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.