Chlorphenoctium
TL;DR: Chlorphenoctium (CAS 47166-61-0) is a chemical compound with molecular formula C17H28Cl2NO+ and molecular weight 332.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,4-dichlorophenoxy)methyl-dimethyl-octylazanium
Also Known As: Chlorphenoctium, CHLORPHENOCTIUM ION, CHLORPHENOCTIUM CATION, (2,4-dichlorophenoxy)methyl-dimethyl-octyl-azanium, (2,4-dichlorophenoxy)methyl-dimethyl-octylazanium
| Molecular Formula | C17H28Cl2NO+ |
|---|---|
| Molecular Weight | 332.15 g/mol |
| LogP | 6.7 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 10 |
| Exact Mass | 332.1548 |
| Heavy Atoms | 21 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 47166-61-0 |
|---|---|
| SMILES | CCCCCCCC[N+](C)(C)COC1=C(C=C(C=C1)Cl)Cl |
| InChIKey | MPFGBTBBXXRJCD-UHFFFAOYSA-N |
Product Overview
Chlorphenoctium (CAS 47166-61-0), with molecular formula C17H28Cl2NO+ and molecular weight 332.15 g/mol. IUPAC: (2,4-dichlorophenoxy)methyl-dimethyl-octylazanium.
Chemical Property Profile of Chlorphenoctium
Property Insights of Chlorphenoctium
The XLogP value of 6.7 indicates that Chlorphenoctium is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.2 Ų, Chlorphenoctium exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Chlorphenoctium 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 Chlorphenoctium?
The CAS number of Chlorphenoctium is 47166-61-0.
What is the molecular formula of Chlorphenoctium?
The molecular formula of Chlorphenoctium is C17H28Cl2NO+.
What is the molecular weight of Chlorphenoctium?
The molecular weight of Chlorphenoctium is 332.15 g/mol.
Where can I buy Chlorphenoctium?
You can request a quote for Chlorphenoctium directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chlorphenoctium?
Yes, KEHONG BIO provides custom synthesis services for Chlorphenoctium and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.