2-(5-Nitro-1H-imidazol-1-yl)ethanol
TL;DR: 2-(5-Nitro-1H-imidazol-1-yl)ethanol (CAS 5006-68-8) 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.
2-(5-nitroimidazol-1-yl)ethanol
Also Known As: 2-(5-Nitro-1H-imidazol-1-yl)ethanol, 5-Nitro-1H-imidazole-1-ethanol, Metronidazole Impurity D, 2-(5-nitroimidazol-1-yl)ethanol, 1H-Imidazole-1-ethanol, 5-nitro-
| Molecular Formula | C5H7N3O3 |
|---|---|
| Molecular Weight | 157.05 g/mol |
| LogP | -0.2164 |
| Topological Polar Surface Area | 81.19 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 | 5006-68-8 |
|---|---|
| SMILES | C1=C(N(C=N1)CCO)[N+](=O)[O-] |
Product Overview
2-(5-Nitro-1H-imidazol-1-yl)ethanol (CAS 5006-68-8), with molecular formula C5H7N3O3 and molecular weight 157.05 g/mol. IUPAC: 2-(5-nitroimidazol-1-yl)ethanol.
Chemical Property Profile of 2-(5-Nitro-1H-imidazol-1-yl)ethanol
Property Insights of 2-(5-Nitro-1H-imidazol-1-yl)ethanol
The XLogP value of -0.2164 indicates that 2-(5-Nitro-1H-imidazol-1-yl)ethanol is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 81.19 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(5-Nitro-1H-imidazol-1-yl)ethanol. Following Lipinski's Rule of Five, 2-(5-Nitro-1H-imidazol-1-yl)ethanol 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 2-(5-Nitro-1H-imidazol-1-yl)ethanol?
The CAS number of 2-(5-Nitro-1H-imidazol-1-yl)ethanol is 5006-68-8.
What is the molecular formula of 2-(5-Nitro-1H-imidazol-1-yl)ethanol?
The molecular formula of 2-(5-Nitro-1H-imidazol-1-yl)ethanol is C5H7N3O3.
What is the molecular weight of 2-(5-Nitro-1H-imidazol-1-yl)ethanol?
The molecular weight of 2-(5-Nitro-1H-imidazol-1-yl)ethanol is 157.05 g/mol.
Where can I buy 2-(5-Nitro-1H-imidazol-1-yl)ethanol?
You can request a quote for 2-(5-Nitro-1H-imidazol-1-yl)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(5-Nitro-1H-imidazol-1-yl)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-(5-Nitro-1H-imidazol-1-yl)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.