Diethyl cyclopropane-1,2-dicarboxylate
TL;DR: Diethyl cyclopropane-1,2-dicarboxylate (CAS 20561-09-5) is a chemical compound with molecular formula C9H14O4 and molecular weight 186.0892 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl cyclopropane-1,2-dicarboxylate
Also Known As: Diethyl cyclopropane-1,2-dicarboxylate, Diethyl 1,2-cyclopropanedicarboxylate, cyclopropane-1,2-dicarboxylic acid diethyl ester, Diethyl trans-1,2-cyclopropanedicarboxylate, RARECHEM AL BI 0655
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C9H14O4 |
| Molecular Weight | 186.0892 g/mol |
| XLogP | 0.8 |
| Topological Polar Surface Area (TPSA) | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 186.0892 Da |
| Heavy Atoms | 13 |
| Complexity | 190.0 |
| SMILES | CCOC(=O)C1CC1C(=O)OCC |
| InChIKey | SXLDHZFJMXLFJU-UHFFFAOYSA-N |
Chemical Property Profile of Diethyl cyclopropane-1,2-dicarboxylate
Property Insights of Diethyl cyclopropane-1,2-dicarboxylate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl cyclopropane-1,2-dicarboxylate. With a topological polar surface area (TPSA) of 52.6 Ų, Diethyl cyclopropane-1,2-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethyl cyclopropane-1,2-dicarboxylate has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Diethyl cyclopropane-1,2-dicarboxylate?
The CAS number of Diethyl cyclopropane-1,2-dicarboxylate is 20561-09-5.
What is the molecular formula of Diethyl cyclopropane-1,2-dicarboxylate?
The molecular formula of Diethyl cyclopropane-1,2-dicarboxylate is C9H14O4.
What is the molecular weight of Diethyl cyclopropane-1,2-dicarboxylate?
The molecular weight of Diethyl cyclopropane-1,2-dicarboxylate is 186.0892 g/mol.
Where can I buy Diethyl cyclopropane-1,2-dicarboxylate?
You can request a quote for Diethyl cyclopropane-1,2-dicarboxylate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diethyl cyclopropane-1,2-dicarboxylate?
Yes, CoreyChem provides custom synthesis services for Diethyl cyclopropane-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.