alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate
TL;DR: alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate (CAS 125161-49-1) is a chemical compound with molecular formula C21H34O9 and molecular weight 430.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R)-2-[(3aR,5R,6S,6aR)-6-butanoyloxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-butanoyloxyethyl] butanoate
Also Known As: alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate, 1,2-O-(1-Methylethylidene)-alpha-D-glucofuranose tributanoate, Tri-O-butanyl-3,5,6 O-isopropylidene-1,2-alpha-D-glucofurannose, Tri-O-butanyl-3,5,6 O-isopropylidene-1,2-alpha-D-glucofurannose [French], 3,5,6-Tri-O-butanoyl-1,2-O-(1-methylethylidene)-alpha-D-glucofuranose
| Molecular Formula | C21H34O9 |
|---|---|
| Molecular Weight | 430.22 g/mol |
| LogP | 2.6299 |
| Topological Polar Surface Area | 106.59 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 430.22028 |
| Heavy Atoms | 30 |
| Complexity | 603.2845 |
Chemical Identifiers
| CAS Number | 125161-49-1 |
|---|---|
| SMILES | CCCC(=O)OC[C@H]([C@@H]1[C@@H]([C@@H]2[C@H](O1)OC(O2)(C)C)OC(=O)CCC)OC(=O)CCC |
Product Overview
alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate (CAS 125161-49-1), with molecular formula C21H34O9 and molecular weight 430.22 g/mol. IUPAC: [(2R)-2-[(3aR,5R,6S,6aR)-6-butanoyloxy-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]-2-butanoyloxyethyl] butanoate.
Chemical Property Profile of alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate
Property Insights of alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate
The XLogP value of 2.6299 suggests moderate lipophilicity, balancing water solubility and membrane permeability for alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate. The TPSA of 106.59 Ų falls within the moderate polarity range, balancing permeability and solubility for alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate. Following Lipinski's Rule of Five, alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate 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 alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate?
The CAS number of alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate is 125161-49-1.
What is the molecular formula of alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate?
The molecular formula of alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate is C21H34O9.
What is the molecular weight of alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate?
The molecular weight of alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate is 430.22 g/mol.
Where can I buy alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate?
You can request a quote for alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate?
Yes, KEHONG BIO provides custom synthesis services for alpha-D-Glucofuranose, 1,2-O-(1-methylethylidene)-, tributanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.