2-Anilino-2-oxoethanesulfonic acid
TL;DR: 2-Anilino-2-oxoethanesulfonic acid (CAS 46341-18-8) is a chemical compound with molecular formula C8H9NO4S and molecular weight 215.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-anilino-2-oxoethanesulfonic acid
Also Known As: 2-anilino-2-oxoethanesulfonic acid, (PHENYLCARBAMOYL)METHANESULFONIC ACID, 2-Anilino-2-oxoethane-1-sulfonic acid
| Molecular Formula | C8H9NO4S |
|---|---|
| Molecular Weight | 215.03 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 91.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 215.02522 |
| Heavy Atoms | 14 |
| Complexity | 287.0 |
Chemical Identifiers
| CAS Number | 46341-18-8 |
|---|---|
| SMILES | C1=CC=C(C=C1)NC(=O)CS(=O)(=O)O |
| InChIKey | IRNJFJKNPWTGKE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Anilino-2-oxoethanesulfonic acid (CAS 46341-18-8), with molecular formula C8H9NO4S and molecular weight 215.03 g/mol. IUPAC: 2-anilino-2-oxoethanesulfonic acid.
Chemical Property Profile of 2-Anilino-2-oxoethanesulfonic acid
Property Insights of 2-Anilino-2-oxoethanesulfonic acid
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Anilino-2-oxoethanesulfonic acid. The TPSA of 91.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Anilino-2-oxoethanesulfonic acid. Following Lipinski's Rule of Five, 2-Anilino-2-oxoethanesulfonic acid has 2 hydrogen bond donor(s) and 4 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-Anilino-2-oxoethanesulfonic acid?
The CAS number of 2-Anilino-2-oxoethanesulfonic acid is 46341-18-8.
What is the molecular formula of 2-Anilino-2-oxoethanesulfonic acid?
The molecular formula of 2-Anilino-2-oxoethanesulfonic acid is C8H9NO4S.
What is the molecular weight of 2-Anilino-2-oxoethanesulfonic acid?
The molecular weight of 2-Anilino-2-oxoethanesulfonic acid is 215.03 g/mol.
Where can I buy 2-Anilino-2-oxoethanesulfonic acid?
You can request a quote for 2-Anilino-2-oxoethanesulfonic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Anilino-2-oxoethanesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-Anilino-2-oxoethanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.