4-ethoxy-5-nitro-1H-imidazole
TL;DR: 4-ethoxy-5-nitro-1H-imidazole (CAS 87243-08-1) is a chemical compound with molecular formula C5H7N3O3 and molecular weight 157.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-ethoxy-5-nitro-1H-imidazole
Also Known As: 4-ethoxy-5-nitro-1H-imidazole, 1H-Imidazole, 4-ethoxy-5-nitro-, 5-ethoxy-4-nitro-1H-imidazole, 1H-Imidazole, 5-ethoxy-4-nitro-, 4(5)-Nitro-5(4)-ethoxyimidazole
| Molecular Formula | C5H7N3O3 |
|---|---|
| Molecular Weight | 157.05 g/mol |
| LogP | 0.7166 |
| Topological Polar Surface Area | 81.05 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 157.04874 |
| Heavy Atoms | 11 |
| Complexity | 257.23026 |
Chemical Identifiers
| CAS Number | 87243-08-1 |
|---|---|
| SMILES | CCOC1=C(NC=N1)[N+](=O)[O-] |
Product Overview
4-ethoxy-5-nitro-1H-imidazole (CAS 87243-08-1), with molecular formula C5H7N3O3 and molecular weight 157.05 g/mol. IUPAC: 4-ethoxy-5-nitro-1H-imidazole.
Chemical Property Profile of 4-ethoxy-5-nitro-1H-imidazole
Property Insights of 4-ethoxy-5-nitro-1H-imidazole
The XLogP value of 0.7166 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-ethoxy-5-nitro-1H-imidazole. The TPSA of 81.05 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-ethoxy-5-nitro-1H-imidazole. Following Lipinski's Rule of Five, 4-ethoxy-5-nitro-1H-imidazole has 1 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 4-ethoxy-5-nitro-1H-imidazole?
The CAS number of 4-ethoxy-5-nitro-1H-imidazole is 87243-08-1.
What is the molecular formula of 4-ethoxy-5-nitro-1H-imidazole?
The molecular formula of 4-ethoxy-5-nitro-1H-imidazole is C5H7N3O3.
What is the molecular weight of 4-ethoxy-5-nitro-1H-imidazole?
The molecular weight of 4-ethoxy-5-nitro-1H-imidazole is 157.05 g/mol.
Where can I buy 4-ethoxy-5-nitro-1H-imidazole?
You can request a quote for 4-ethoxy-5-nitro-1H-imidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-ethoxy-5-nitro-1H-imidazole?
Yes, KEHONG BIO provides custom synthesis services for 4-ethoxy-5-nitro-1H-imidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.