Lauryl isoquinolinium chloride
TL;DR: Lauryl isoquinolinium chloride (CAS 71732-96-2) is a chemical compound with molecular formula C21H32ClN and molecular weight 333.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-dodecylisoquinolin-2-ium chloride
Also Known As: lauryl isoquinolinium chloride, 2-Dodecylisoquinolinium chloride, N-LAURYLISOQUINOLINIUM CHLORIDE, Isoquinolinium, 2-dodecyl-, chloride, 2-dodecylisoquinolin-2-ium chloride
| Molecular Formula | C21H32ClN |
|---|---|
| Molecular Weight | 333.22 g/mol |
| LogP | 3.05 |
| Topological Polar Surface Area | 3.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 11 |
| Exact Mass | 333.22232 |
| Heavy Atoms | 23 |
| Complexity | 263.0 |
Chemical Identifiers
| CAS Number | 71732-96-2 |
|---|---|
| SMILES | CCCCCCCCCCCC[N+]1=CC2=CC=CC=C2C=C1.[Cl-] |
| InChIKey | WBXDKDRNXQVSGV-UHFFFAOYSA-M |
Patent-Derived Application Labels
Derived from 11 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Lauryl isoquinolinium chloride (CAS 71732-96-2), with molecular formula C21H32ClN and molecular weight 333.22 g/mol. IUPAC: 2-dodecylisoquinolin-2-ium chloride.
Chemical Property Profile of Lauryl isoquinolinium chloride
Property Insights of Lauryl isoquinolinium chloride
The XLogP value of 3.05 indicates that Lauryl isoquinolinium chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 3.9 Ų, Lauryl isoquinolinium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lauryl isoquinolinium chloride 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
Frequently Asked Questions
What is the CAS number of Lauryl isoquinolinium chloride?
The CAS number of Lauryl isoquinolinium chloride is 71732-96-2.
What is the molecular formula of Lauryl isoquinolinium chloride?
The molecular formula of Lauryl isoquinolinium chloride is C21H32ClN.
What is the molecular weight of Lauryl isoquinolinium chloride?
The molecular weight of Lauryl isoquinolinium chloride is 333.22 g/mol.
Where can I buy Lauryl isoquinolinium chloride?
You can request a quote for Lauryl isoquinolinium chloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lauryl isoquinolinium chloride?
Yes, KEHONG BIO provides custom synthesis services for Lauryl isoquinolinium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.