Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate
TL;DR: Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate (CAS 64558-01-6) is a chemical compound with molecular formula C14H16O6 and molecular weight 280.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate
Also Known As: dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate, BAS 00667268, 1,3-dimethyl4,8-dioxoadamantane-1,3-dicarboxylate, 1,3-DIMETHYL 4,8-DIOXOADAMANTANE-1,3-DICARBOXYLATE, dimethyl 4,8-dioxo-1,3-adamantanedicarboxylate
| Molecular Formula | C14H16O6 |
|---|---|
| Molecular Weight | 280.09 g/mol |
| LogP | 0.277 |
| Topological Polar Surface Area | 86.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 280.0947 |
| Heavy Atoms | 20 |
| Complexity | 491.78223 |
Chemical Identifiers
| CAS Number | 64558-01-6 |
|---|---|
| SMILES | COC(=O)C12CC3CC(C1=O)CC(C2)(C3=O)C(=O)OC |
Product Overview
Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate (CAS 64558-01-6), with molecular formula C14H16O6 and molecular weight 280.09 g/mol. IUPAC: dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate.
Chemical Property Profile of Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate
Property Insights of Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate
The XLogP value of 0.277 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate. The TPSA of 86.74 Ų falls within the moderate polarity range, balancing permeability and solubility for Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate. Following Lipinski's Rule of Five, Dimethyl 4,8-dioxoadamantane-1,3-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 4,8-dioxoadamantane-1,3-dicarboxylate?
The CAS number of Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate is 64558-01-6.
What is the molecular formula of Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate?
The molecular formula of Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate is C14H16O6.
What is the molecular weight of Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate?
The molecular weight of Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate is 280.09 g/mol.
Where can I buy Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate?
You can request a quote for Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Dimethyl 4,8-dioxoadamantane-1,3-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.