1,2-Dithiolane-4,4-dimethanol, 1-oxide
TL;DR: 1,2-Dithiolane-4,4-dimethanol, 1-oxide (CAS 3083-92-9) is a chemical compound with molecular formula C5H10O3S2 and molecular weight 182.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(hydroxymethyl)-1-oxodithiolan-4-yl]methanol
Also Known As: 1,2-Dithiolane-4,4-dimethanol, 1-oxide, 1-Oxo-4,4-dimethanol-1,2-dithiolane, 1,2-Dithiolane-4,4-dimethanol,1-oxide, [4-(hydroxymethyl)-1-oxodithiolan-4-yl]methanol, [4-(hydroxymethyl)-1-oxo-dithiolan-4-yl]methanol
| Molecular Formula | C5H10O3S2 |
|---|---|
| Molecular Weight | 182.01 g/mol |
| LogP | -1.6 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 182.00714 |
| Heavy Atoms | 10 |
| Complexity | 144.0 |
Chemical Identifiers
| CAS Number | 3083-92-9 |
|---|---|
| SMILES | C1C(CS(=O)S1)(CO)CO |
| InChIKey | CAHFIPJGULUPBZ-UHFFFAOYSA-N |
Product Overview
1,2-Dithiolane-4,4-dimethanol, 1-oxide (CAS 3083-92-9), with molecular formula C5H10O3S2 and molecular weight 182.01 g/mol. IUPAC: [4-(hydroxymethyl)-1-oxodithiolan-4-yl]methanol.
Chemical Property Profile of 1,2-Dithiolane-4,4-dimethanol, 1-oxide
Property Insights of 1,2-Dithiolane-4,4-dimethanol, 1-oxide
The XLogP value of -1.6 indicates that 1,2-Dithiolane-4,4-dimethanol, 1-oxide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,2-Dithiolane-4,4-dimethanol, 1-oxide. Following Lipinski's Rule of Five, 1,2-Dithiolane-4,4-dimethanol, 1-oxide has 2 hydrogen bond donor(s) and 5 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 1,2-Dithiolane-4,4-dimethanol, 1-oxide?
The CAS number of 1,2-Dithiolane-4,4-dimethanol, 1-oxide is 3083-92-9.
What is the molecular formula of 1,2-Dithiolane-4,4-dimethanol, 1-oxide?
The molecular formula of 1,2-Dithiolane-4,4-dimethanol, 1-oxide is C5H10O3S2.
What is the molecular weight of 1,2-Dithiolane-4,4-dimethanol, 1-oxide?
The molecular weight of 1,2-Dithiolane-4,4-dimethanol, 1-oxide is 182.01 g/mol.
Where can I buy 1,2-Dithiolane-4,4-dimethanol, 1-oxide?
You can request a quote for 1,2-Dithiolane-4,4-dimethanol, 1-oxide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2-Dithiolane-4,4-dimethanol, 1-oxide?
Yes, KEHONG BIO provides custom synthesis services for 1,2-Dithiolane-4,4-dimethanol, 1-oxide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.