N,N,N-Triethylanilinium phenylsulphonate
TL;DR: N,N,N-Triethylanilinium phenylsulphonate (CAS 84434-16-2) 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.
benzenesulfonic acid;triethyl(phenyl)azanium
Also Known As: EINECS 282-815-3, N,N,N-Triethylanilinium phenylsulphonate, benzenesulfonic acid; triethyl(phenyl)azanium, N,N,N-TRIETHYLANILINIUM PHENYLSULFONATE
| Molecular Formula | C18H26NO3S+ |
|---|---|
| Molecular Weight | 336.16 g/mol |
| LogP | 3.9869 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 336.16333 |
| Heavy Atoms | 23 |
| Complexity | 657.6629 |
Chemical Identifiers
| CAS Number | 84434-16-2 |
|---|---|
| SMILES | CC[N+](CC)(CC)C1=CC=CC=C1.C1=CC=C(C=C1)S(=O)(=O)O |
Product Overview
N,N,N-Triethylanilinium phenylsulphonate (CAS 84434-16-2), with molecular formula C18H26NO3S+ and molecular weight 336.16 g/mol. IUPAC: benzenesulfonic acid;triethyl(phenyl)azanium.
Chemical Property Profile of N,N,N-Triethylanilinium phenylsulphonate
Property Insights of N,N,N-Triethylanilinium phenylsulphonate
The XLogP value of 3.9869 indicates that N,N,N-Triethylanilinium phenylsulphonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, N,N,N-Triethylanilinium phenylsulphonate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N,N-Triethylanilinium phenylsulphonate has 1 hydrogen bond donor(s) and 2 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 N,N,N-Triethylanilinium phenylsulphonate?
The CAS number of N,N,N-Triethylanilinium phenylsulphonate is 84434-16-2.
What is the molecular formula of N,N,N-Triethylanilinium phenylsulphonate?
The molecular formula of N,N,N-Triethylanilinium phenylsulphonate is C18H26NO3S+.
What is the molecular weight of N,N,N-Triethylanilinium phenylsulphonate?
The molecular weight of N,N,N-Triethylanilinium phenylsulphonate is 336.16 g/mol.
Where can I buy N,N,N-Triethylanilinium phenylsulphonate?
You can request a quote for N,N,N-Triethylanilinium phenylsulphonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N,N-Triethylanilinium phenylsulphonate?
Yes, KEHONG BIO provides custom synthesis services for N,N,N-Triethylanilinium phenylsulphonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.