(2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate
TL;DR: (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate (CAS 80483-13-2) is a chemical compound with molecular formula C12H17BrO7 and molecular weight 352.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4,5-diacetyloxy-6-bromo-2-methyloxan-3-yl) acetate
Also Known As: Acetobromofucose, Blood Group H disaccharide, Tri-O-acetyl-alpha-rhamnopyranosyl bromide, 2,3,4-tri-O-acetyl-D-fucopyranosyl bromide, 2,3,4-Tri-O-acetyl-a-L-fucopyranosyl bromide
| Molecular Formula | C12H17BrO7 |
|---|---|
| Molecular Weight | 352.02 g/mol |
| LogP | 0.9212 |
| Topological Polar Surface Area | 88.13 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 352.01578 |
| Heavy Atoms | 20 |
| Complexity | 369.2671 |
Chemical Identifiers
| CAS Number | 80483-13-2 |
|---|---|
| SMILES | CC1C(C(C(C(O1)Br)OC(=O)C)OC(=O)C)OC(=O)C |
Product Overview
(2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate (CAS 80483-13-2), with molecular formula C12H17BrO7 and molecular weight 352.02 g/mol. IUPAC: (4,5-diacetyloxy-6-bromo-2-methyloxan-3-yl) acetate.
Chemical Property Profile of (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate
Property Insights of (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate
The XLogP value of 0.9212 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate. The TPSA of 88.13 Ų falls within the moderate polarity range, balancing permeability and solubility for (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate. Following Lipinski's Rule of Five, (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate has 0 hydrogen bond donor(s) and 7 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 (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate?
The CAS number of (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate is 80483-13-2.
What is the molecular formula of (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate?
The molecular formula of (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate is C12H17BrO7.
What is the molecular weight of (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate?
The molecular weight of (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate is 352.02 g/mol.
Where can I buy (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate?
You can request a quote for (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate?
Yes, KEHONG BIO provides custom synthesis services for (2S,3R,4R,5S,6S)-2-Bromo-6-methyltetrahydro-2H-pyran-3,4,5-triyl triacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.