Ethyl 5,6-O-(oxomethylidene)hexofuranoside
TL;DR: Ethyl 5,6-O-(oxomethylidene)hexofuranoside (CAS 46687-78-9) is a chemical compound with molecular formula C9H14O7 and molecular weight 234.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5-ethoxy-3,4-dihydroxyoxolan-2-yl)-1,3-dioxolan-2-one
Also Known As: Ethyl 5,6-O-(oxomethylidene)hexofuranoside, 4-(5-ethoxy-3,4-dihydroxyoxolan-2-yl)-1,3-dioxolan-2-one
| Molecular Formula | C9H14O7 |
|---|---|
| Molecular Weight | 234.07 g/mol |
| LogP | -0.8 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 234.07396 |
| Heavy Atoms | 16 |
| Complexity | 269.0 |
Chemical Identifiers
| CAS Number | 46687-78-9 |
|---|---|
| SMILES | CCOC1C(C(C(O1)C2COC(=O)O2)O)O |
| InChIKey | RMQVHWPGWURFMF-UHFFFAOYSA-N |
Product Overview
Ethyl 5,6-O-(oxomethylidene)hexofuranoside (CAS 46687-78-9), with molecular formula C9H14O7 and molecular weight 234.07 g/mol. IUPAC: 4-(5-ethoxy-3,4-dihydroxyoxolan-2-yl)-1,3-dioxolan-2-one.
Chemical Property Profile of Ethyl 5,6-O-(oxomethylidene)hexofuranoside
Property Insights of Ethyl 5,6-O-(oxomethylidene)hexofuranoside
The XLogP value of -0.8 indicates that Ethyl 5,6-O-(oxomethylidene)hexofuranoside is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 5,6-O-(oxomethylidene)hexofuranoside. Following Lipinski's Rule of Five, Ethyl 5,6-O-(oxomethylidene)hexofuranoside has 2 hydrogen bond donor(s) and 7 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 Ethyl 5,6-O-(oxomethylidene)hexofuranoside?
The CAS number of Ethyl 5,6-O-(oxomethylidene)hexofuranoside is 46687-78-9.
What is the molecular formula of Ethyl 5,6-O-(oxomethylidene)hexofuranoside?
The molecular formula of Ethyl 5,6-O-(oxomethylidene)hexofuranoside is C9H14O7.
What is the molecular weight of Ethyl 5,6-O-(oxomethylidene)hexofuranoside?
The molecular weight of Ethyl 5,6-O-(oxomethylidene)hexofuranoside is 234.07 g/mol.
Where can I buy Ethyl 5,6-O-(oxomethylidene)hexofuranoside?
You can request a quote for Ethyl 5,6-O-(oxomethylidene)hexofuranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 5,6-O-(oxomethylidene)hexofuranoside?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 5,6-O-(oxomethylidene)hexofuranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.