重氮乙酸乙酯
TL;DR: 重氮乙酸乙酯 (CAS 623-73-4) is a chemical compound with molecular formula C4H6N2O2 and molecular weight 114.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
重氮乙酸乙酯
ethyl 2-diazoacetate
Also Known As: Ethyl diazoacetate, Diazoacetic ester, Ethyl 2-diazoacetate, Ethyldiazoacetate, DAAE
| Molecular Formula | C4H6N2O2 |
|---|---|
| Molecular Weight | 114.04 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 28.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 114.04293 |
| Heavy Atoms | 8 |
| Complexity | 126.0 |
| Density | 1.085 @25 °C |
Chemical Identifiers
| CAS Number | 623-73-4 |
|---|---|
| SMILES | CCOC(=O)C=[N+]=[N-] |
| InChIKey | YVPJCJLMRRTDMQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
重氮乙酸乙酯 (CAS 623-73-4), with molecular formula C4H6N2O2 and molecular weight 114.04 g/mol. IUPAC: ethyl 2-diazoacetate.
Chemical Property Profile of 重氮乙酸乙酯
Property Insights of 重氮乙酸乙酯
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 重氮乙酸乙酯. With a topological polar surface area (TPSA) of 28.3 Ų, 重氮乙酸乙酯 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 重氮乙酸乙酯 has 0 hydrogen bond donor(s) and 3 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 重氮乙酸乙酯?
The CAS number of 重氮乙酸乙酯 is 623-73-4.
What is the molecular formula of 重氮乙酸乙酯?
The molecular formula of 重氮乙酸乙酯 is C4H6N2O2.
What is the molecular weight of 重氮乙酸乙酯?
The molecular weight of 重氮乙酸乙酯 is 114.04 g/mol.
Where can I buy 重氮乙酸乙酯?
You can request a quote for 重氮乙酸乙酯 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 重氮乙酸乙酯?
Yes, KEHONG BIO provides custom synthesis services for 重氮乙酸乙酯 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.