![[3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate structure](/static/products/5965/5965-65-1.webp)
[3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate
TL;DR: [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate (CAS 5965-65-1) is a chemical compound with molecular formula C21H26O10 and molecular weight 438.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3,4,5-triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate
Also Known As: 2-Methylphenyl 2,3,4,6-tetra-O-acetylhexopyranoside, .beta.-D-Glucopyranoside, tetraacetate, Glucopyranoside, tetraacetate, .beta.-D-, o-Cresol-.beta.-D-glucoside tetraacetate, [3,4,5-triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate
| Molecular Formula | C21H26O10 |
|---|---|
| Molecular Weight | 438.15 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 124.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 438.1526 |
| Heavy Atoms | 31 |
| Complexity | 663.0 |
Chemical Identifiers
| CAS Number | 5965-65-1 |
|---|---|
| SMILES | CC1=CC=CC=C1OC2C(C(C(C(O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C |
| InChIKey | XVGNADCCCZEHRJ-UHFFFAOYSA-N |
Product Overview
[3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate (CAS 5965-65-1), with molecular formula C21H26O10 and molecular weight 438.15 g/mol. IUPAC: [3,4,5-triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate.
Chemical Property Profile of [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate
Property Insights of [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate. Following Lipinski's Rule of Five, [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate has 0 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 [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate?
The CAS number of [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate is 5965-65-1.
What is the molecular formula of [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate?
The molecular formula of [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate is C21H26O10.
What is the molecular weight of [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate?
The molecular weight of [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate is 438.15 g/mol.
Where can I buy [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate?
You can request a quote for [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-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 [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate?
Yes, KEHONG BIO provides custom synthesis services for [3,4,5-Triacetyloxy-6-(2-methylphenoxy)oxan-2-yl]methyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.