cis-Diethyl cyclopropane-1,2-dicarboxylate
TL;DR: cis-Diethyl cyclopropane-1,2-dicarboxylate (CAS 681473-07-4) is a chemical compound with molecular formula C9H14O4 and molecular weight 186.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
cis-diethyl (1S,2R)-cyclopropane-1,2-dicarboxylate
Also Known As: cis-Diethyl cyclopropane-1,2-dicarboxylate, Diethyl cis-cyclopropane-1,2-dicarboxylate, diethyl cis-1,2-cyclopropanedicarboxylate, diethyl (1R,2S)-cyclopropane-1,2-dicarboxylate, Diethylcis-cyclopropane-1,2-dicarboxylate
| Molecular Formula | C9H14O4 |
|---|---|
| Molecular Weight | 186.09 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 186.0892 |
| Heavy Atoms | 13 |
| Complexity | 190.0 |
Chemical Identifiers
| CAS Number | 681473-07-4 |
|---|---|
| SMILES | CCOC(=O)[C@@H]1C[C@@H]1C(=O)OCC |
| InChIKey | SXLDHZFJMXLFJU-KNVOCYPGSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
cis-Diethyl cyclopropane-1,2-dicarboxylate (CAS 681473-07-4), with molecular formula C9H14O4 and molecular weight 186.09 g/mol. IUPAC: cis-diethyl (1S,2R)-cyclopropane-1,2-dicarboxylate.
Chemical Property Profile of cis-Diethyl cyclopropane-1,2-dicarboxylate
Property Insights of cis-Diethyl cyclopropane-1,2-dicarboxylate
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for cis-Diethyl cyclopropane-1,2-dicarboxylate. With a topological polar surface area (TPSA) of 52.6 Ų, cis-Diethyl cyclopropane-1,2-dicarboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, cis-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
Frequently Asked Questions
What is the CAS number of cis-Diethyl cyclopropane-1,2-dicarboxylate?
The CAS number of cis-Diethyl cyclopropane-1,2-dicarboxylate is 681473-07-4.
What is the molecular formula of cis-Diethyl cyclopropane-1,2-dicarboxylate?
The molecular formula of cis-Diethyl cyclopropane-1,2-dicarboxylate is C9H14O4.
What is the molecular weight of cis-Diethyl cyclopropane-1,2-dicarboxylate?
The molecular weight of cis-Diethyl cyclopropane-1,2-dicarboxylate is 186.09 g/mol.
Where can I buy cis-Diethyl cyclopropane-1,2-dicarboxylate?
You can request a quote for cis-Diethyl cyclopropane-1,2-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for cis-Diethyl cyclopropane-1,2-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for cis-Diethyl cyclopropane-1,2-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.