Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid
TL;DR: Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid (CAS 22703-25-9) is a chemical compound with molecular formula C18H26NO3S+ and molecular weight 336.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid
Also Known As: benzyl-ethyl-dimethylazanium; 4-methylbenzenesulfonic acid, BENZYL-ETHYL-DIMETHYL-AZANIUM; 4-METHYLBENZENESULFONIC ACID
| Molecular Formula | C18H26NO3S+ |
|---|---|
| Molecular Weight | 336.16 g/mol |
| LogP | 3.52462 |
| Topological Polar Surface Area | 62.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 336.16333 |
| Heavy Atoms | 23 |
| Complexity | 329.0 |
Chemical Identifiers
| CAS Number | 22703-25-9 |
|---|---|
| SMILES | CC[N+](C)(C)CC1=CC=CC=C1.CC1=CC=C(C=C1)S(=O)(=O)O |
| InChIKey | XKVLVEGOCWCHCK-UHFFFAOYSA-N |
Product Overview
Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid (CAS 22703-25-9), with molecular formula C18H26NO3S+ and molecular weight 336.16 g/mol. IUPAC: benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid.
Chemical Property Profile of Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid
Property Insights of Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid
The XLogP value of 3.52462 indicates that Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid. Following Lipinski's Rule of Five, Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid has 1 hydrogen bond donor(s) and 3 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 Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid?
The CAS number of Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid is 22703-25-9.
What is the molecular formula of Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid?
The molecular formula of Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid is C18H26NO3S+.
What is the molecular weight of Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid?
The molecular weight of Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid is 336.16 g/mol.
Where can I buy Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid?
You can request a quote for Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for Benzyl-ethyl-dimethylazanium;4-methylbenzenesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.