![Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate structure](/static/products/5469/54696-28-5.webp)
Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate
TL;DR: Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate (CAS 54696-28-5) is a chemical compound with molecular formula C13H16O6 and molecular weight 268.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate
Also Known As: dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate, (1R,3S,5R,7S)-dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate, 2,6-Dioxo-bicyclo[3.3.1]nonane-3,7-dicarboxylic acid dimethyl ester, methyl 7-(methoxycarbonyl)-2,6-dioxobicyclo[3.3.1]nonane-3-carboxylate
| Molecular Formula | C13H16O6 |
|---|---|
| Molecular Weight | 268.09 g/mol |
| LogP | 0.1329 |
| Topological Polar Surface Area | 86.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 268.0947 |
| Heavy Atoms | 19 |
| Complexity | 400.4144 |
Chemical Identifiers
| CAS Number | 54696-28-5 |
|---|---|
| SMILES | COC(=O)C1CC2CC(C1=O)CC(C2=O)C(=O)OC |
Product Overview
Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate (CAS 54696-28-5), with molecular formula C13H16O6 and molecular weight 268.09 g/mol. IUPAC: dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate.
Chemical Property Profile of Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate
Property Insights of Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate
The XLogP value of 0.1329 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate. The TPSA of 86.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate has 0 hydrogen bond donor(s) and 6 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 Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate?
The CAS number of Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate is 54696-28-5.
What is the molecular formula of Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate?
The molecular formula of Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate is C13H16O6.
What is the molecular weight of Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate?
The molecular weight of Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate is 268.09 g/mol.
Where can I buy Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate?
You can request a quote for Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 2,6-dioxobicyclo[3.3.1]nonane-3,7-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.