2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide
TL;DR: 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide (CAS 36456-49-2) is a chemical compound with molecular formula C9H10O4S2 and molecular weight 246.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-phenyl-1,3-dithiolane 1,1,3,3-tetraoxide
Also Known As: 2-phenyl-1,3-dithiolane 1,1,3,3-tetraoxide
| Molecular Formula | C9H10O4S2 |
|---|---|
| Molecular Weight | 246.00 g/mol |
| LogP | 0.5284 |
| Topological Polar Surface Area | 68.28 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 246.00204 |
| Heavy Atoms | 15 |
| Complexity | 523.3897 |
Chemical Identifiers
| CAS Number | 36456-49-2 |
|---|---|
| SMILES | C1CS(=O)(=O)C(S1(=O)=O)C2=CC=CC=C2 |
Product Overview
2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide (CAS 36456-49-2), with molecular formula C9H10O4S2 and molecular weight 246.00 g/mol. IUPAC: 2-phenyl-1,3-dithiolane 1,1,3,3-tetraoxide.
Chemical Property Profile of 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide
Property Insights of 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide
The XLogP value of 0.5284 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide. The TPSA of 68.28 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide. Following Lipinski's Rule of Five, 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide 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-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide?
The CAS number of 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide is 36456-49-2.
What is the molecular formula of 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide?
The molecular formula of 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide is C9H10O4S2.
What is the molecular weight of 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide?
The molecular weight of 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide is 246.00 g/mol.
Where can I buy 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide?
You can request a quote for 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide?
Yes, KEHONG BIO provides custom synthesis services for 2-Phenyl-1,3-dithiolane 1,1,3,3-tetraoxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.