2-(Benzoylamino)ethanesulfonic acid
TL;DR: 2-(Benzoylamino)ethanesulfonic acid (CAS 67619-92-5) is a chemical compound with molecular formula C9H11NO4S and molecular weight 229.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-benzamidoethanesulfonic acid
Also Known As: N-benzoyltaurine, 2-benzamidoethanesulfonic acid, 2-(BENZOYLAMINO)ETHANESULFONIC ACID, 2-Benzamidoethane-1-sulfonic acid, N-benzoyl-2-aminoethanesulfonic acid
| Molecular Formula | C9H11NO4S |
|---|---|
| Molecular Weight | 229.04 g/mol |
| LogP | 0.3042 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.04088 |
| Heavy Atoms | 15 |
| Complexity | 426.6854 |
Chemical Identifiers
| CAS Number | 67619-92-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)NCCS(=O)(=O)O |
Product Overview
2-(Benzoylamino)ethanesulfonic acid (CAS 67619-92-5), with molecular formula C9H11NO4S and molecular weight 229.04 g/mol. IUPAC: 2-benzamidoethanesulfonic acid.
Chemical Property Profile of 2-(Benzoylamino)ethanesulfonic acid
Property Insights of 2-(Benzoylamino)ethanesulfonic acid
The XLogP value of 0.3042 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Benzoylamino)ethanesulfonic acid. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(Benzoylamino)ethanesulfonic acid. Following Lipinski's Rule of Five, 2-(Benzoylamino)ethanesulfonic acid has 2 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-(Benzoylamino)ethanesulfonic acid?
The CAS number of 2-(Benzoylamino)ethanesulfonic acid is 67619-92-5.
What is the molecular formula of 2-(Benzoylamino)ethanesulfonic acid?
The molecular formula of 2-(Benzoylamino)ethanesulfonic acid is C9H11NO4S.
What is the molecular weight of 2-(Benzoylamino)ethanesulfonic acid?
The molecular weight of 2-(Benzoylamino)ethanesulfonic acid is 229.04 g/mol.
Where can I buy 2-(Benzoylamino)ethanesulfonic acid?
You can request a quote for 2-(Benzoylamino)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-(Benzoylamino)ethanesulfonic acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(Benzoylamino)ethanesulfonic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.