(2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate
TL;DR: (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate (CAS 80953-32-8) 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.
(2,3,4-triacetyloxy-5,6-dihydroxycyclohexyl) acetate
Also Known As: 1,4,5,6-Tetraacetate, 3,4,5,6-Tetra-O-acetyl myo-Inositol, (2,3,4-triacetyloxy-5,6-dihydroxycyclohexyl) acetate, (2,3,4-triacetyloxy-5,6-dihydroxy-cyclohexyl) acetate, 3,4,5,6-Tetra-O-acetyl-D-myo-inositol
| Molecular Formula | C14H20O10 |
|---|---|
| Molecular Weight | 348.11 g/mol |
| LogP | -1.4 |
| Topological Polar Surface Area | 146.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 348.10565 |
| Heavy Atoms | 24 |
| Complexity | 470.0 |
Chemical Identifiers
| CAS Number | 80953-32-8 |
|---|---|
| SMILES | CC(=O)OC1C(C(C(C(C1OC(=O)C)OC(=O)C)OC(=O)C)O)O |
| InChIKey | ZQLBHQSQMQLFBM-UHFFFAOYSA-N |
Product Overview
(2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate (CAS 80953-32-8), with molecular formula C14H20O10 and molecular weight 348.11 g/mol. IUPAC: (2,3,4-triacetyloxy-5,6-dihydroxycyclohexyl) acetate.
Chemical Property Profile of (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate
Property Insights of (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate
The XLogP value of -1.4 indicates that (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 146.0 Ų indicates high polarity, suggesting (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate has 2 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 (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate?
The CAS number of (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate is 80953-32-8.
What is the molecular formula of (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate?
The molecular formula of (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate is C14H20O10.
What is the molecular weight of (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate?
The molecular weight of (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate is 348.11 g/mol.
Where can I buy (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate?
You can request a quote for (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate 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-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate?
Yes, KEHONG BIO provides custom synthesis services for (2,3,4-Triacetyloxy-5,6-dihydroxycyclohexyl) acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.