2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate
TL;DR: 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate (CAS 13639-54-8) is a chemical compound with molecular formula C17H24O10S2 and molecular weight 452.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl]methyl acetate
Also Known As: 3969AD, HY-W700094, 2,3,4,6-Tetra-O-acetyl-, A-D-glucopyranosyl Ethylxanthate, 2,3,4,6-Tetra-O-acetyl-b-D-glucopyranosyl ethylxanthate
| Molecular Formula | C17H24O10S2 |
|---|---|
| Molecular Weight | 452.08 g/mol |
| LogP | 1.1241 |
| Topological Polar Surface Area | 123.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.0811 |
| Heavy Atoms | 29 |
| Complexity | 637.7031 |
Chemical Identifiers
| CAS Number | 13639-54-8 |
|---|---|
| SMILES | CCOC(=S)S[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
Product Overview
2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate (CAS 13639-54-8), with molecular formula C17H24O10S2 and molecular weight 452.08 g/mol. IUPAC: [(2R,3R,4S,5R,6S)-3,4,5-triacetyloxy-6-ethoxycarbothioylsulfanyloxan-2-yl]methyl acetate.
Chemical Property Profile of 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate
Property Insights of 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate
The XLogP value of 1.1241 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate. The TPSA of 123.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate. Following Lipinski's Rule of Five, 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate?
The CAS number of 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate is 13639-54-8.
What is the molecular formula of 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate?
The molecular formula of 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate is C17H24O10S2.
What is the molecular weight of 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate?
The molecular weight of 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate is 452.08 g/mol.
Where can I buy 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate?
You can request a quote for 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate?
Yes, KEHONG BIO provides custom synthesis services for 2,3,4,6-Tetra-O-acetyl-beta-D-glucopyranosyl Ethylxanthate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.