2-(4,5-dinitro-1H-imidazol-1-yl)ethanol
TL;DR: 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol (CAS 117259-21-9) is a chemical compound with molecular formula C5H6N4O5 and molecular weight 202.03381 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4,5-dinitroimidazol-1-yl)ethanol
Also Known As: 4,5-Dinitro-1H-imidazole-1-ethanol, 2-(4,5-dinitroimidazol-1-yl)ethanol, 2-(4,5-dinitroimidazolyl)ethan-1-ol, 2-{4,5-bisnitro-1H-imidazol-1-yl}ethanol, 2-(4,5-Dinitro-imidazol-1-yl)-ethanol
Technical Specifications
| Molecular Formula | C5H6N4O5 |
| Molecular Weight | 202.03381 g/mol |
| XLogP | -0.3 |
| Topological Polar Surface Area (TPSA) | 130.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.03381 Da |
| Heavy Atoms | 14 |
| Complexity | 235.0 |
| SMILES | C1=NC(=C(N1CCO)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | CMYZHWIAUSMICT-UHFFFAOYSA-N |
Chemical Property Profile of 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol
Property Insights of 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol
The XLogP value of -0.3 indicates that 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 130.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol. Following Lipinski's Rule of Five, 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol has 1 hydrogen bond donor(s) and 6 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-(4,5-dinitro-1H-imidazol-1-yl)ethanol?
The CAS number of 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol is 117259-21-9.
What is the molecular formula of 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol?
The molecular formula of 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol is C5H6N4O5.
What is the molecular weight of 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol?
The molecular weight of 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol is 202.03381 g/mol.
Where can I buy 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol?
You can request a quote for 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol?
Yes, CoreyChem provides custom synthesis services for 2-(4,5-dinitro-1H-imidazol-1-yl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.