3-diazo-4-ethoxycarbonyl-3H-pyrazol
TL;DR: 3-diazo-4-ethoxycarbonyl-3H-pyrazol (CAS 64781-75-5) is a chemical compound with molecular formula C6H6N4O2 and molecular weight 166.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-diazopyrazole-4-carboxylate
Also Known As: 3-diazo-4-ethoxycarbonyl-3H-pyrazol, (3-diazoniopyrazol-4-ylidene)-ethoxymethanolate, (3-diazoniopyrazol-4-ylidene)-ethoxy-methanolate, (E)-(3-Diazonio-4H-pyrazol-4-ylidene)(ethoxy)methanolate
| Molecular Formula | C6H6N4O2 |
|---|---|
| Molecular Weight | 166.05 g/mol |
| LogP | 0.5275 |
| Topological Polar Surface Area | 87.42 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 166.04907 |
| Heavy Atoms | 12 |
| Complexity | 311.50977 |
Chemical Identifiers
| CAS Number | 64781-75-5 |
|---|---|
| SMILES | CCOC(=O)C1=CN=NC1=[N+]=[N-] |
Product Overview
3-diazo-4-ethoxycarbonyl-3H-pyrazol (CAS 64781-75-5), with molecular formula C6H6N4O2 and molecular weight 166.05 g/mol. IUPAC: ethyl 3-diazopyrazole-4-carboxylate.
Chemical Property Profile of 3-diazo-4-ethoxycarbonyl-3H-pyrazol
Property Insights of 3-diazo-4-ethoxycarbonyl-3H-pyrazol
The XLogP value of 0.5275 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-diazo-4-ethoxycarbonyl-3H-pyrazol. The TPSA of 87.42 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-diazo-4-ethoxycarbonyl-3H-pyrazol. Following Lipinski's Rule of Five, 3-diazo-4-ethoxycarbonyl-3H-pyrazol 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 3-diazo-4-ethoxycarbonyl-3H-pyrazol?
The CAS number of 3-diazo-4-ethoxycarbonyl-3H-pyrazol is 64781-75-5.
What is the molecular formula of 3-diazo-4-ethoxycarbonyl-3H-pyrazol?
The molecular formula of 3-diazo-4-ethoxycarbonyl-3H-pyrazol is C6H6N4O2.
What is the molecular weight of 3-diazo-4-ethoxycarbonyl-3H-pyrazol?
The molecular weight of 3-diazo-4-ethoxycarbonyl-3H-pyrazol is 166.05 g/mol.
Where can I buy 3-diazo-4-ethoxycarbonyl-3H-pyrazol?
You can request a quote for 3-diazo-4-ethoxycarbonyl-3H-pyrazol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-diazo-4-ethoxycarbonyl-3H-pyrazol?
Yes, KEHONG BIO provides custom synthesis services for 3-diazo-4-ethoxycarbonyl-3H-pyrazol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.