2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose
TL;DR: 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose (CAS 80779-87-9) 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.
(3,4,6-triacetyloxy-5-phenylmethoxyoxan-2-yl)methyl acetate
Also Known As: 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose, 2-O-BENZYL-1,3,4,6-TETRA-O-ACETYL-alpha-D-MANNOPYRANOSE, (3,4,6-triacetyloxy-5-phenylmethoxyoxan-2-yl)methyl acetate, [3,4,6-tris(acetyloxy)-5-(benzyloxy)oxan-2-yl]methyl acetate, [2,5-diacetyloxy-6-(acetyloxymethyl)-3-phenylmethoxy-oxan-4-yl] Acetate
| Molecular Formula | C21H26O10 |
|---|---|
| Molecular Weight | 438.15 g/mol |
| LogP | 1.2863 |
| Topological Polar Surface Area | 123.66 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 438.1526 |
| Heavy Atoms | 31 |
| Complexity | 777.62494 |
Chemical Identifiers
| CAS Number | 80779-87-9 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OCC2=CC=CC=C2)OC(=O)C)OC(=O)C |
Product Overview
2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose (CAS 80779-87-9), with molecular formula C21H26O10 and molecular weight 438.15 g/mol. IUPAC: (3,4,6-triacetyloxy-5-phenylmethoxyoxan-2-yl)methyl acetate.
Chemical Property Profile of 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose
Property Insights of 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose
The XLogP value of 1.2863 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose. The TPSA of 123.66 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose. Following Lipinski's Rule of Five, 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose 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 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose?
The CAS number of 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose is 80779-87-9.
What is the molecular formula of 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose?
The molecular formula of 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose is C21H26O10.
What is the molecular weight of 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose?
The molecular weight of 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose is 438.15 g/mol.
Where can I buy 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose?
You can request a quote for 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose?
Yes, KEHONG BIO provides custom synthesis services for 2-O-Benzyl-1,3,4,6-tetra-O-acetyl-a-D-mannopyranose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.