Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
TL;DR: Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate (CAS 56543-05-6) is a chemical compound with molecular formula C11H18O6 and molecular weight 246.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
Also Known As: isopropylidene-D-tartrate, Diethyl (R,R)-O,O-isopropylidenetartrate, diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate, (4S,5S)-Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate, (+)-Diethyl 2,3-O-isopropylidene-D-tartrate
| Molecular Formula | C11H18O6 |
|---|---|
| Molecular Weight | 246.11 g/mol |
| LogP | 1.1 |
| Topological Polar Surface Area | 71.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 246.11034 |
| Heavy Atoms | 17 |
| Complexity | 270.0 |
Chemical Identifiers
| CAS Number | 56543-05-6 |
|---|---|
| SMILES | CCOC(=O)C1C(OC(O1)(C)C)C(=O)OCC |
| InChIKey | MCNKHXZIPATURB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate (CAS 56543-05-6), with molecular formula C11H18O6 and molecular weight 246.11 g/mol. IUPAC: diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate.
Chemical Property Profile of Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
Property Insights of Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate
The XLogP value of 1.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate. The TPSA of 71.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate. Following Lipinski's Rule of Five, Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-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 Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate?
The CAS number of Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate is 56543-05-6.
What is the molecular formula of Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate?
The molecular formula of Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate is C11H18O6.
What is the molecular weight of Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate?
The molecular weight of Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate is 246.11 g/mol.
Where can I buy Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate?
You can request a quote for Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl 2,2-dimethyl-1,3-dioxolane-4,5-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.