2,3-Dicarbethoxyaziridine
TL;DR: 2,3-Dicarbethoxyaziridine (CAS 168113-12-0) is a chemical compound with molecular formula C8H13NO4 and molecular weight 187.08446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
diethyl aziridine-2,3-dicarboxylate
Also Known As: 2,3-Dicarbethoxyaziridine, 2,3-diethyl aziridine-2,3-dicarboxylate, diethyl aziridine-2,3-dicarboxylate, Diethyl 2,3-aziridinedicarboxylate, Diethyl 2,3-aziridinedicarboxylate #
Application Areas
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H13NO4 |
| Molecular Weight | 187.08446 g/mol |
| XLogP | 0.2 |
| Topological Polar Surface Area (TPSA) | 74.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 187.08446 Da |
| Heavy Atoms | 13 |
| Complexity | 194.0 |
| SMILES | CCOC(=O)C1C(N1)C(=O)OCC |
| InChIKey | ZDCRASVHGJDHRS-UHFFFAOYSA-N |
Chemical Property Profile of 2,3-Dicarbethoxyaziridine
Property Insights of 2,3-Dicarbethoxyaziridine
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3-Dicarbethoxyaziridine. The TPSA of 74.5 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,3-Dicarbethoxyaziridine. Following Lipinski's Rule of Five, 2,3-Dicarbethoxyaziridine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 2,3-Dicarbethoxyaziridine?
The CAS number of 2,3-Dicarbethoxyaziridine is 168113-12-0.
What is the molecular formula of 2,3-Dicarbethoxyaziridine?
The molecular formula of 2,3-Dicarbethoxyaziridine is C8H13NO4.
What is the molecular weight of 2,3-Dicarbethoxyaziridine?
The molecular weight of 2,3-Dicarbethoxyaziridine is 187.08446 g/mol.
Where can I buy 2,3-Dicarbethoxyaziridine?
You can request a quote for 2,3-Dicarbethoxyaziridine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,3-Dicarbethoxyaziridine?
Yes, CoreyChem provides custom synthesis services for 2,3-Dicarbethoxyaziridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.