(3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate
TL;DR: (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate (CAS 27086-14-2) is a chemical compound with molecular formula C14H20O10 and molecular weight 348.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3,5,6-triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate
Also Known As: 1,2,4,6-Tetraacetyl-d-glucose, 1,2,4,6-Tetra-O-acetyl-b-D-glucopyranose, (3,5,6-triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate, [3,5,6-tris(acetyloxy)-4-hydroxyoxan-2-yl]methyl acetate, (3,5,6-triacetoxy-4-hydroxy-tetrahydropyran-2-yl)methyl acetate
| Molecular Formula | C14H20O10 |
|---|---|
| Molecular Weight | 348.11 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 9 |
| Exact Mass | 348.10565 |
| Heavy Atoms | 24 |
| Complexity | 502.0 |
Chemical Identifiers
| CAS Number | 27086-14-2 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OC(=O)C)O)OC(=O)C |
| InChIKey | VEXTUPCIMUQWAO-UHFFFAOYSA-N |
Product Overview
(3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate (CAS 27086-14-2), with molecular formula C14H20O10 and molecular weight 348.11 g/mol. IUPAC: (3,5,6-triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate.
Chemical Property Profile of (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate
Property Insights of (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate. Following Lipinski's Rule of Five, (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate has 1 hydrogen bond donor(s) and 10 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 (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate?
The CAS number of (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate is 27086-14-2.
What is the molecular formula of (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate?
The molecular formula of (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate is C14H20O10.
What is the molecular weight of (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate?
The molecular weight of (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate is 348.11 g/mol.
Where can I buy (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate?
You can request a quote for (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate?
Yes, KEHONG BIO provides custom synthesis services for (3,5,6-Triacetyloxy-4-hydroxyoxan-2-yl)methyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.