(2-Phenylethenesulfonyl)acetate
TL;DR: (2-Phenylethenesulfonyl)acetate (CAS 92207-24-4) is a chemical compound with molecular formula C10H9O4S- and molecular weight 225.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-phenylethenylsulfonyl)acetate
Also Known As: (2-Phenylethenesulfonyl)acetate, z-styrylsulfonylacetic acid, 2-(2-phenylethenylsulfonyl)acetate, CIS-STYRENESULFONYLACETIC ACID, (2-Phenylethene-1-sulfonyl)acetate
| Molecular Formula | C10H9O4S- |
|---|---|
| Molecular Weight | 225.02 g/mol |
| LogP | -0.178 |
| Topological Polar Surface Area | 74.27 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.02216 |
| Heavy Atoms | 15 |
| Complexity | 459.45557 |
Chemical Identifiers
| CAS Number | 92207-24-4 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CS(=O)(=O)CC(=O)[O-] |
Product Overview
(2-Phenylethenesulfonyl)acetate (CAS 92207-24-4), with molecular formula C10H9O4S- and molecular weight 225.02 g/mol. IUPAC: 2-(2-phenylethenylsulfonyl)acetate.
Chemical Property Profile of (2-Phenylethenesulfonyl)acetate
Property Insights of (2-Phenylethenesulfonyl)acetate
The XLogP value of -0.178 indicates that (2-Phenylethenesulfonyl)acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 74.27 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Phenylethenesulfonyl)acetate. Following Lipinski's Rule of Five, (2-Phenylethenesulfonyl)acetate has 0 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-Phenylethenesulfonyl)acetate?
The CAS number of (2-Phenylethenesulfonyl)acetate is 92207-24-4.
What is the molecular formula of (2-Phenylethenesulfonyl)acetate?
The molecular formula of (2-Phenylethenesulfonyl)acetate is C10H9O4S-.
What is the molecular weight of (2-Phenylethenesulfonyl)acetate?
The molecular weight of (2-Phenylethenesulfonyl)acetate is 225.02 g/mol.
Where can I buy (2-Phenylethenesulfonyl)acetate?
You can request a quote for (2-Phenylethenesulfonyl)acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Phenylethenesulfonyl)acetate?
Yes, KEHONG BIO provides custom synthesis services for (2-Phenylethenesulfonyl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.