1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose
TL;DR: 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose (CAS 79414-66-7) is a chemical compound with molecular formula C26H30O9 and molecular weight 486.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,6-diacetyloxy-3,5-bis(phenylmethoxy)oxan-2-yl]methyl acetate
Also Known As: 2,2-Diphenylethyl isothiocyanate, 1,4,6-TRI-O-ACETYL-2,3-O-CARBONYL-ALPHA-D-MANNOPYRANOSE, 2,4-Di-O-benzyl-1,3,6-tri-O-acetyl-a-D-glucopyranose, [4,6-diacetyloxy-3,5-bis(phenylmethoxy)oxan-2-yl]methyl acetate, [2-acetyloxy-6-(acetyloxymethyl)-3,5-bis(phenylmethoxy)oxan-4-yl] Acetate
| Molecular Formula | C26H30O9 |
|---|---|
| Molecular Weight | 486.19 g/mol |
| LogP | 2.94 |
| Topological Polar Surface Area | 106.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 10 |
| Exact Mass | 486.189 |
| Heavy Atoms | 35 |
| Complexity | 963.3024 |
Chemical Identifiers
| CAS Number | 79414-66-7 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C(C(O1)OC(=O)C)OCC2=CC=CC=C2)OC(=O)C)OCC3=CC=CC=C3 |
Product Overview
1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose (CAS 79414-66-7), with molecular formula C26H30O9 and molecular weight 486.19 g/mol. IUPAC: [4,6-diacetyloxy-3,5-bis(phenylmethoxy)oxan-2-yl]methyl acetate.
Chemical Property Profile of 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose
Property Insights of 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose
The XLogP value of 2.94 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose. The TPSA of 106.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose. Following Lipinski's Rule of Five, 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose has 0 hydrogen bond donor(s) and 9 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 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose?
The CAS number of 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose is 79414-66-7.
What is the molecular formula of 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose?
The molecular formula of 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose is C26H30O9.
What is the molecular weight of 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose?
The molecular weight of 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose is 486.19 g/mol.
Where can I buy 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose?
You can request a quote for 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose?
Yes, KEHONG BIO provides custom synthesis services for 1,4,6-Tri-O-acetyl-2,3-O-carbonyl-alpha-D-mannopyranose and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.