(3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate
TL;DR: (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate (CAS 37463-76-6) is a chemical compound with molecular formula C8H12O6S and molecular weight 236.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(3R,4S)-4-acetyloxy-1,1-dioxothiolan-3-yl] acetate
Also Known As: (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate, [(3S,4R)-4-acetyloxy-1,1-dioxothiolan-3-yl] acetate, (3R,4S)-1,1-dioxidotetrahydrothiophene-3,4-diyl diacetate
| Molecular Formula | C8H12O6S |
|---|---|
| Molecular Weight | 236.04 g/mol |
| LogP | -0.7218 |
| Topological Polar Surface Area | 86.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 236.03546 |
| Heavy Atoms | 15 |
| Complexity | 340.59314 |
Chemical Identifiers
| CAS Number | 37463-76-6 |
|---|---|
| SMILES | CC(=O)O[C@@H]1CS(=O)(=O)C[C@@H]1OC(=O)C |
Product Overview
(3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate (CAS 37463-76-6), with molecular formula C8H12O6S and molecular weight 236.04 g/mol. IUPAC: [(3R,4S)-4-acetyloxy-1,1-dioxothiolan-3-yl] acetate.
Chemical Property Profile of (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate
Property Insights of (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate
The XLogP value of -0.7218 indicates that (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 86.74 Ų falls within the moderate polarity range, balancing permeability and solubility for (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate. Following Lipinski's Rule of Five, (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate has 0 hydrogen bond donor(s) and 6 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 (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate?
The CAS number of (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate is 37463-76-6.
What is the molecular formula of (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate?
The molecular formula of (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate is C8H12O6S.
What is the molecular weight of (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate?
The molecular weight of (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate is 236.04 g/mol.
Where can I buy (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate?
You can request a quote for (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate?
Yes, KEHONG BIO provides custom synthesis services for (3R,4S)-1,1-dioxidotetrahydrothiene-3,4-diyl diacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.