beta-D-threo-2-Pentulofuranoside, methyl, triacetate
TL;DR: beta-D-threo-2-Pentulofuranoside, methyl, triacetate (CAS 54451-98-8) is a chemical compound with molecular formula C12H18O8 and molecular weight 290.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4R)-3,4-diacetyloxy-2-methoxyoxolan-2-yl]methyl acetate
Also Known As: beta-D-threo-2-Pentulofuranoside, methyl, triacetate, [-4-acetyloxy-5-5-methoxy-oxolan-3-yl]acetate, Methyl 1,3,4-tri-O-acetylpent-2-ulofuranoside, [ -4-acetyloxy-5- -5-methoxy-oxolan-3-yl]acetate, methyl 1,3,4-tri-O-acetyl-beta-D-xylulofuranoside
| Molecular Formula | C12H18O8 |
|---|---|
| Molecular Weight | 290.10 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 97.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 290.10016 |
| Heavy Atoms | 20 |
| Complexity | 393.0 |
Chemical Identifiers
| CAS Number | 54451-98-8 |
|---|---|
| SMILES | CC(=O)OC[C@@]1([C@H]([C@@H](CO1)OC(=O)C)OC(=O)C)OC |
| InChIKey | RXYNMOMIMSXMKK-GRYCIOLGSA-N |
Product Overview
beta-D-threo-2-Pentulofuranoside, methyl, triacetate (CAS 54451-98-8), with molecular formula C12H18O8 and molecular weight 290.10 g/mol. IUPAC: [(2R,3S,4R)-3,4-diacetyloxy-2-methoxyoxolan-2-yl]methyl acetate.
Chemical Property Profile of beta-D-threo-2-Pentulofuranoside, methyl, triacetate
Property Insights of beta-D-threo-2-Pentulofuranoside, methyl, triacetate
The XLogP value of -0.5 indicates that beta-D-threo-2-Pentulofuranoside, methyl, triacetate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 97.4 Ų falls within the moderate polarity range, balancing permeability and solubility for beta-D-threo-2-Pentulofuranoside, methyl, triacetate. Following Lipinski's Rule of Five, beta-D-threo-2-Pentulofuranoside, methyl, triacetate has 0 hydrogen bond donor(s) and 8 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 beta-D-threo-2-Pentulofuranoside, methyl, triacetate?
The CAS number of beta-D-threo-2-Pentulofuranoside, methyl, triacetate is 54451-98-8.
What is the molecular formula of beta-D-threo-2-Pentulofuranoside, methyl, triacetate?
The molecular formula of beta-D-threo-2-Pentulofuranoside, methyl, triacetate is C12H18O8.
What is the molecular weight of beta-D-threo-2-Pentulofuranoside, methyl, triacetate?
The molecular weight of beta-D-threo-2-Pentulofuranoside, methyl, triacetate is 290.10 g/mol.
Where can I buy beta-D-threo-2-Pentulofuranoside, methyl, triacetate?
You can request a quote for beta-D-threo-2-Pentulofuranoside, methyl, triacetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for beta-D-threo-2-Pentulofuranoside, methyl, triacetate?
Yes, KEHONG BIO provides custom synthesis services for beta-D-threo-2-Pentulofuranoside, methyl, triacetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.