Octafonium
TL;DR: Octafonium (CAS 6735-92-8) is a chemical compound with molecular formula C27H42NO+ and molecular weight 396.33 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-diethyl-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethyl]azanium
Also Known As: Octafonium, Octafonium ion, Octafonium cation, Octafonium chloride, Benzyldiethyl(2-(4-(1,1,3,3-tetramethylbutyl)phenoxy)ethyl)ammonium
| Molecular Formula | C27H42NO+ |
|---|---|
| Molecular Weight | 396.33 g/mol |
| LogP | 7.6 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 11 |
| Exact Mass | 396.32663 |
| Heavy Atoms | 29 |
| Complexity | 446.0 |
Chemical Identifiers
| CAS Number | 6735-92-8 |
|---|---|
| SMILES | CC[N+](CC)(CCOC1=CC=C(C=C1)C(C)(C)CC(C)(C)C)CC2=CC=CC=C2 |
| InChIKey | BSFQRHLBLCUWLG-UHFFFAOYSA-N |
Product Overview
Octafonium (CAS 6735-92-8), with molecular formula C27H42NO+ and molecular weight 396.33 g/mol. IUPAC: benzyl-diethyl-[2-[4-(2,4,4-trimethylpentan-2-yl)phenoxy]ethyl]azanium.
Chemical Property Profile of Octafonium
Property Insights of Octafonium
The XLogP value of 7.6 indicates that Octafonium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Octafonium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Octafonium has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Octafonium?
The CAS number of Octafonium is 6735-92-8.
What is the molecular formula of Octafonium?
The molecular formula of Octafonium is C27H42NO+.
What is the molecular weight of Octafonium?
The molecular weight of Octafonium is 396.33 g/mol.
Where can I buy Octafonium?
You can request a quote for Octafonium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Octafonium?
Yes, KEHONG BIO provides custom synthesis services for Octafonium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.