6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose
TL;DR: 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose (CAS 3254-32-8) is a chemical compound with molecular formula C16H20O7 and molecular weight 324.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-hydroxy-2-(6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl)ethyl] benzoate
Also Known As: 6-o-benzoyl-1,2-o-(1-methylethylidene)hexofuranose, [2-hydroxy-2-(6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl)ethyl] benzoate, RefChem:309213
| Molecular Formula | C16H20O7 |
|---|---|
| Molecular Weight | 324.12 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 94.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 324.1209 |
| Heavy Atoms | 23 |
| Complexity | 432.0 |
Chemical Identifiers
| CAS Number | 3254-32-8 |
|---|---|
| SMILES | CC1(OC2C(C(OC2O1)C(COC(=O)C3=CC=CC=C3)O)O)C |
| InChIKey | YZTNJMSUDMOQJM-UHFFFAOYSA-N |
Product Overview
6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose (CAS 3254-32-8), with molecular formula C16H20O7 and molecular weight 324.12 g/mol. IUPAC: [2-hydroxy-2-(6-hydroxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl)ethyl] benzoate.
Chemical Property Profile of 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose
Property Insights of 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose. The TPSA of 94.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose. Following Lipinski's Rule of Five, 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose 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 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose?
The CAS number of 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose is 3254-32-8.
What is the molecular formula of 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose?
The molecular formula of 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose is C16H20O7.
What is the molecular weight of 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose?
The molecular weight of 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose is 324.12 g/mol.
Where can I buy 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose?
You can request a quote for 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose?
Yes, KEHONG BIO provides custom synthesis services for 6-o-Benzoyl-1,2-o-(1-methylethylidene)hexofuranose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.