Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro-
TL;DR: Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro- (CAS 54965-22-9) is a chemical compound with molecular formula C8H13N3O3 and molecular weight 199.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(2-ethoxyethyl)-2-methyl-4-nitroimidazole
Also Known As: Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro-, 1-(2-ethoxyethyl)-2-methyl-4-nitro-1h-imidazole, 1-(Ethoxyethyl)-2-methyl-4-nitroimidazole, 1-(2-ethoxyethyl)-2-methyl-4-nitroimidazole, 5-23-05-00079 (Beilstein Handbook Reference)
| Molecular Formula | C8H13N3O3 |
|---|---|
| Molecular Weight | 199.10 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 72.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 199.09569 |
| Heavy Atoms | 14 |
| Complexity | 195.0 |
Chemical Identifiers
| CAS Number | 54965-22-9 |
|---|---|
| SMILES | CCOCCN1C=C(N=C1C)[N+](=O)[O-] |
| InChIKey | XSSBSOSWWJRPTK-UHFFFAOYSA-N |
Product Overview
Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro- (CAS 54965-22-9), with molecular formula C8H13N3O3 and molecular weight 199.10 g/mol. IUPAC: 1-(2-ethoxyethyl)-2-methyl-4-nitroimidazole.
Chemical Property Profile of Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro-
Property Insights of Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro-
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro-. The TPSA of 72.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro-. Following Lipinski's Rule of Five, Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro- 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 Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro-?
The CAS number of Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro- is 54965-22-9.
What is the molecular formula of Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro-?
The molecular formula of Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro- is C8H13N3O3.
What is the molecular weight of Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro-?
The molecular weight of Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro- is 199.10 g/mol.
Where can I buy Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro-?
You can request a quote for Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Imidazole, 1-(ethoxyethyl)-2-methyl-4-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.