3-Phenyloxathiolane 2,2-dioxide
TL;DR: 3-Phenyloxathiolane 2,2-dioxide (CAS 3244-65-3) is a chemical compound with molecular formula C9H10O3S and molecular weight 198.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenyloxathiolane 2,2-dioxide
Also Known As: 3-phenyloxathiolane 2,2-dioxide, 3-phenyl-1,2-oxathiolane2,2-dioxide, 3-phenyl-1,2-oxathiolane 2,2-dioxide, 3-Phenyl-1,2lambda~6~-oxathiolane-2,2-dione, 1,2-Oxathiolane,3-phenyl-, 2,2-dioxide
| Molecular Formula | C9H10O3S |
|---|---|
| Molecular Weight | 198.04 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 198.03506 |
| Heavy Atoms | 13 |
| Complexity | 259.0 |
Chemical Identifiers
| CAS Number | 3244-65-3 |
|---|---|
| SMILES | C1COS(=O)(=O)C1C2=CC=CC=C2 |
| InChIKey | PBXVQKQXOJYKRP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Phenyloxathiolane 2,2-dioxide (CAS 3244-65-3), with molecular formula C9H10O3S and molecular weight 198.04 g/mol. IUPAC: 3-phenyloxathiolane 2,2-dioxide.
Chemical Property Profile of 3-Phenyloxathiolane 2,2-dioxide
Property Insights of 3-Phenyloxathiolane 2,2-dioxide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Phenyloxathiolane 2,2-dioxide. With a topological polar surface area (TPSA) of 51.8 Ų, 3-Phenyloxathiolane 2,2-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Phenyloxathiolane 2,2-dioxide has 0 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 3-Phenyloxathiolane 2,2-dioxide?
The CAS number of 3-Phenyloxathiolane 2,2-dioxide is 3244-65-3.
What is the molecular formula of 3-Phenyloxathiolane 2,2-dioxide?
The molecular formula of 3-Phenyloxathiolane 2,2-dioxide is C9H10O3S.
What is the molecular weight of 3-Phenyloxathiolane 2,2-dioxide?
The molecular weight of 3-Phenyloxathiolane 2,2-dioxide is 198.04 g/mol.
Where can I buy 3-Phenyloxathiolane 2,2-dioxide?
You can request a quote for 3-Phenyloxathiolane 2,2-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Phenyloxathiolane 2,2-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 3-Phenyloxathiolane 2,2-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.