(2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol
TL;DR: (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol (CAS 146511-93-5) is a chemical compound with molecular formula C6H12O2S2 and molecular weight 180.02788 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol
Also Known As: 2,5-DIMETHYL-[1,4]DITHIANE-2,5-DIOL, (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol
Technical Specifications
| Molecular Formula | C6H12O2S2 |
| Molecular Weight | 180.02788 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 180.02788 Da |
| Heavy Atoms | 10 |
| Complexity | 126.0 |
| SMILES | C[C@@]1(CS[C@](CS1)(C)O)O |
| InChIKey | NHKIYYMFGJBOTK-OLQVQODUSA-N |
Chemical Property Profile of (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol
Property Insights of (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol. Following Lipinski's Rule of Five, (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol?
The CAS number of (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol is 146511-93-5.
What is the molecular formula of (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol?
The molecular formula of (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol is C6H12O2S2.
What is the molecular weight of (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol?
The molecular weight of (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol is 180.02788 g/mol.
Where can I buy (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol?
You can request a quote for (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol?
Yes, CoreyChem provides custom synthesis services for (2S,5R)-2,5-dimethyl-1,4-dithiane-2,5-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.