Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside
TL;DR: Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside (CAS 41834-62-2) is a chemical compound with molecular formula C29H28O11S and molecular weight 584.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4,5-dibenzoyloxy-6-methoxy-3-methylsulfonyloxyoxan-2-yl)methyl benzoate
Also Known As: Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside, methyl 2,3,6-tri-o-benzoyl-4-o-(methylsulfonyl)hexopyranoside, (4,5-dibenzoyloxy-6-methoxy-3-methylsulfonyloxyoxan-2-yl)methyl benzoate, [4,5-bis(benzoyloxy)-3-(methanesulfonyloxy)-6-methoxyoxan-2-yl]methyl benzoate
| Molecular Formula | C29H28O11S |
|---|---|
| Molecular Weight | 584.14 g/mol |
| LogP | 4.2 |
| Topological Polar Surface Area | 149.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 13 |
| Exact Mass | 584.13525 |
| Heavy Atoms | 41 |
| Complexity | 975.0 |
Chemical Identifiers
| CAS Number | 41834-62-2 |
|---|---|
| SMILES | COC1C(C(C(C(O1)COC(=O)C2=CC=CC=C2)OS(=O)(=O)C)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4 |
| InChIKey | BZZKVTLAQUOKQK-UHFFFAOYSA-N |
Product Overview
Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside (CAS 41834-62-2), with molecular formula C29H28O11S and molecular weight 584.14 g/mol. IUPAC: (4,5-dibenzoyloxy-6-methoxy-3-methylsulfonyloxyoxan-2-yl)methyl benzoate.
Chemical Property Profile of Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside
Property Insights of Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside
The XLogP value of 4.2 indicates that Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 149.0 Ų indicates high polarity, suggesting Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside has 0 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside?
The CAS number of Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside is 41834-62-2.
What is the molecular formula of Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside?
The molecular formula of Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside is C29H28O11S.
What is the molecular weight of Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside?
The molecular weight of Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside is 584.14 g/mol.
Where can I buy Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside?
You can request a quote for Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2,3,6-tri-O-benzoyl-4-O-(methanesulfonyl)hexopyranoside and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.