(3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate
TL;DR: (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate (CAS 158511-57-0) is a chemical compound with molecular formula C17H24O10S2 and molecular weight 452.0811 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(3,4,5-triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate
Also Known As: (3,4,5-triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate, hexopyranose, 1-s-(ethoxythioxomethyl)-1-thio-, tetraacetate, 2,3,4,6-Tetra-O-acetyl-, A-D-glucopyranosyl Ethylxanthate, 2,3,4,6-Tetra-O-acetyl-b-D-glucopyranosyl ethylxanthate
Technical Specifications
| Molecular Formula | C17H24O10S2 |
| Molecular Weight | 452.0811 g/mol |
| XLogP | 2.5 |
| Topological Polar Surface Area (TPSA) | 181.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 13 |
| Exact Mass | 452.0811 Da |
| Heavy Atoms | 29 |
| Complexity | 638.0 |
| SMILES | CCOC(=S)SC1C(C(C(C(O1)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | GYORARISFGRNMU-UHFFFAOYSA-N |
Chemical Property Profile of (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate
Property Insights of (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate. The TPSA of 181.0 Ų indicates high polarity, suggesting (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate?
The CAS number of (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate is 158511-57-0.
What is the molecular formula of (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate?
The molecular formula of (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate is C17H24O10S2.
What is the molecular weight of (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate?
The molecular weight of (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate is 452.0811 g/mol.
Where can I buy (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate?
You can request a quote for (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate?
Yes, CoreyChem provides custom synthesis services for (3,4,5-Triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl)methyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.