1,3-Dithiane, 1,3-dioxide
TL;DR: 1,3-Dithiane, 1,3-dioxide (CAS 90471-08-2) is a chemical compound with molecular formula C4H8O2S2 and molecular weight 152.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,3-dithiane 1,3-dioxide
Also Known As: 1,3-dithiane 1,3-dioxide, 1,3-Dithiane, 1,3-dioxide, 1,3-Dithiane,1,3-dioxide, 1??,3??-DITHIANE-1,3-DIONE, 1,3-dithiane-1,3-diium-1,3-bis(olate)
| Molecular Formula | C4H8O2S2 |
|---|---|
| Molecular Weight | 152.00 g/mol |
| LogP | -0.155 |
| Topological Polar Surface Area | 34.14 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 151.99657 |
| Heavy Atoms | 8 |
| Complexity | 118.0 |
Chemical Identifiers
| CAS Number | 90471-08-2 |
|---|---|
| SMILES | C1CS(=O)CS(=O)C1 |
Product Overview
1,3-Dithiane, 1,3-dioxide (CAS 90471-08-2), with molecular formula C4H8O2S2 and molecular weight 152.00 g/mol. IUPAC: 1,3-dithiane 1,3-dioxide.
Chemical Property Profile of 1,3-Dithiane, 1,3-dioxide
Property Insights of 1,3-Dithiane, 1,3-dioxide
The XLogP value of -0.155 indicates that 1,3-Dithiane, 1,3-dioxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 34.14 Ų, 1,3-Dithiane, 1,3-dioxide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dithiane, 1,3-dioxide has 0 hydrogen bond donor(s) and 2 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 1,3-Dithiane, 1,3-dioxide?
The CAS number of 1,3-Dithiane, 1,3-dioxide is 90471-08-2.
What is the molecular formula of 1,3-Dithiane, 1,3-dioxide?
The molecular formula of 1,3-Dithiane, 1,3-dioxide is C4H8O2S2.
What is the molecular weight of 1,3-Dithiane, 1,3-dioxide?
The molecular weight of 1,3-Dithiane, 1,3-dioxide is 152.00 g/mol.
Where can I buy 1,3-Dithiane, 1,3-dioxide?
You can request a quote for 1,3-Dithiane, 1,3-dioxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dithiane, 1,3-dioxide?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dithiane, 1,3-dioxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.