6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate
TL;DR: 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate (CAS 35816-31-0) is a chemical compound with molecular formula C14H19ClO9 and molecular weight 366.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4,5,6-triacetyloxy-2-(chloromethyl)oxan-3-yl] acetate
Also Known As: 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate, 1,2,3,4-Tetra-O-acetyl-6-chloro-6-deoxyhexopyranose, [4,5,6-triacetyloxy-2-(chloromethyl)oxan-3-yl] acetate, 1,2,3,4-Tetra-O-acetyl-6-chloro-6-deoxy-alpha-D-glucopyranose
| Molecular Formula | C14H19ClO9 |
|---|---|
| Molecular Weight | 366.07 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 114.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 366.07175 |
| Heavy Atoms | 24 |
| Complexity | 506.0 |
Chemical Identifiers
| CAS Number | 35816-31-0 |
|---|---|
| SMILES | CC(=O)OC1C(OC(C(C1OC(=O)C)OC(=O)C)OC(=O)C)CCl |
| InChIKey | NABBGXLHIWQTIZ-UHFFFAOYSA-N |
Product Overview
6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate (CAS 35816-31-0), with molecular formula C14H19ClO9 and molecular weight 366.07 g/mol. IUPAC: [4,5,6-triacetyloxy-2-(chloromethyl)oxan-3-yl] acetate.
Chemical Property Profile of 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate
Property Insights of 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate. The TPSA of 114.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate. Following Lipinski's Rule of Five, 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate 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 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate?
The CAS number of 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate is 35816-31-0.
What is the molecular formula of 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate?
The molecular formula of 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate is C14H19ClO9.
What is the molecular weight of 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate?
The molecular weight of 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate is 366.07 g/mol.
Where can I buy 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate?
You can request a quote for 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate?
Yes, KEHONG BIO provides custom synthesis services for 6-Chloro-6-deoxy-alpha-D-glucopyranose 1,2,3,4-tetraacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.