(6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate
TL;DR: (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate (CAS 10163-09-4) is a chemical compound with molecular formula C13H17NO9 and molecular weight 331.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate
Also Known As: (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate, (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][, 5-[(Acetyloxy)methyl]-2-oxohexahydro-3aH-pyrano[3,2-d][1,3]oxazole-6,7-diyl diacetate, (3aR,5R,6R,7R,7aR)-5-(Acetoxymethyl)-2-oxohexahydro-1H-pyrano[3,2-d]oxazole-6,7-diyl Diacetate, N/A
| Molecular Formula | C13H17NO9 |
|---|---|
| Molecular Weight | 331.09 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 126.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 331.09033 |
| Heavy Atoms | 23 |
| Complexity | 520.0 |
Chemical Identifiers
| CAS Number | 10163-09-4 |
|---|---|
| SMILES | CC(=O)OCC1C(C(C2C(O1)OC(=O)N2)OC(=O)C)OC(=O)C |
| InChIKey | KWCILQJRTBMYNM-UHFFFAOYSA-N |
Product Overview
(6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate (CAS 10163-09-4), with molecular formula C13H17NO9 and molecular weight 331.09 g/mol. IUPAC: (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate.
Chemical Property Profile of (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate
Property Insights of (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate
The XLogP value of -0.6 indicates that (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 126.0 Ų falls within the moderate polarity range, balancing permeability and solubility for (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate. Following Lipinski's Rule of Five, (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate has 1 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 (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate?
The CAS number of (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate is 10163-09-4.
What is the molecular formula of (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate?
The molecular formula of (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate is C13H17NO9.
What is the molecular weight of (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate?
The molecular weight of (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate is 331.09 g/mol.
Where can I buy (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate?
You can request a quote for (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate?
Yes, KEHONG BIO provides custom synthesis services for (6,7-diacetyloxy-2-oxo-1,3a,5,6,7,7a-hexahydropyrano[3,2-d][1,3]oxazol-5-yl)methyl acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.