2-(N-ethylanilino)ethanesulfonic acid
TL;DR: 2-(N-ethylanilino)ethanesulfonic acid (CAS 6421-81-4) is a chemical compound with molecular formula C10H15NO3S and molecular weight 229.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(N-ethylanilino)ethanesulfonic acid
Also Known As: N-Ethyl-N-phenyltaurine, Taurine, N-ethyl-N-phenyl-, 2-(N-ethylanilino)ethanesulfonic acid, 2-(Ethylphenylamino)ethanesulfonic acid, 2-(ethyl(phenyl)amino)ethanesulfonic acid
| Molecular Formula | C10H15NO3S |
|---|---|
| Molecular Weight | 229.08 g/mol |
| LogP | 1.4007 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 229.07727 |
| Heavy Atoms | 15 |
| Complexity | 388.38834 |
Chemical Identifiers
| CAS Number | 6421-81-4 |
|---|---|
| SMILES | CCN(CCS(=O)(=O)O)C1=CC=CC=C1 |
Product Overview
2-(N-ethylanilino)ethanesulfonic acid (CAS 6421-81-4), with molecular formula C10H15NO3S and molecular weight 229.08 g/mol. IUPAC: 2-(N-ethylanilino)ethanesulfonic acid.
Chemical Property Profile of 2-(N-ethylanilino)ethanesulfonic acid
Property Insights of 2-(N-ethylanilino)ethanesulfonic acid
The XLogP value of 1.4007 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(N-ethylanilino)ethanesulfonic acid. With a topological polar surface area (TPSA) of 57.61 Ų, 2-(N-ethylanilino)ethanesulfonic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(N-ethylanilino)ethanesulfonic 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 2-(N-ethylanilino)ethanesulfonic acid?
The CAS number of 2-(N-ethylanilino)ethanesulfonic acid is 6421-81-4.
What is the molecular formula of 2-(N-ethylanilino)ethanesulfonic acid?
The molecular formula of 2-(N-ethylanilino)ethanesulfonic acid is C10H15NO3S.
What is the molecular weight of 2-(N-ethylanilino)ethanesulfonic acid?
The molecular weight of 2-(N-ethylanilino)ethanesulfonic acid is 229.08 g/mol.
Where can I buy 2-(N-ethylanilino)ethanesulfonic acid?
You can request a quote for 2-(N-ethylanilino)ethanesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(N-ethylanilino)ethanesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(N-ethylanilino)ethanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.