Imidazole-5-ethanol, 1-methyl-2-nitro-
TL;DR: Imidazole-5-ethanol, 1-methyl-2-nitro- (CAS 23571-48-4) is a chemical compound with molecular formula C6H9N3O3 and molecular weight 171.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-methyl-2-nitroimidazol-4-yl)ethanol
Also Known As: Imidazole-5-ethanol, 1-methyl-2-nitro-, 1-Methyl-2-nitroimidazole-5-ethanol, 1H-Imidazole-5-ethanol, 1-methyl-2-nitro-, 1-Methyl-2-nitro-1H-imidazole-5-ethanol, 2-(3-methyl-2-nitroimidazol-4-yl)ethanol
| Molecular Formula | C6H9N3O3 |
|---|---|
| Molecular Weight | 171.06 g/mol |
| LogP | -0.6 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.06439 |
| Heavy Atoms | 12 |
| Complexity | 170.0 |
Chemical Identifiers
| CAS Number | 23571-48-4 |
|---|---|
| SMILES | CN1C(=CN=C1[N+](=O)[O-])CCO |
| InChIKey | MMKOENPMBPNDHX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Imidazole-5-ethanol, 1-methyl-2-nitro- (CAS 23571-48-4), with molecular formula C6H9N3O3 and molecular weight 171.06 g/mol. IUPAC: 2-(3-methyl-2-nitroimidazol-4-yl)ethanol.
Chemical Property Profile of Imidazole-5-ethanol, 1-methyl-2-nitro-
Property Insights of Imidazole-5-ethanol, 1-methyl-2-nitro-
The XLogP value of -0.6 indicates that Imidazole-5-ethanol, 1-methyl-2-nitro- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Imidazole-5-ethanol, 1-methyl-2-nitro-. Following Lipinski's Rule of Five, Imidazole-5-ethanol, 1-methyl-2-nitro- 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 Imidazole-5-ethanol, 1-methyl-2-nitro-?
The CAS number of Imidazole-5-ethanol, 1-methyl-2-nitro- is 23571-48-4.
What is the molecular formula of Imidazole-5-ethanol, 1-methyl-2-nitro-?
The molecular formula of Imidazole-5-ethanol, 1-methyl-2-nitro- is C6H9N3O3.
What is the molecular weight of Imidazole-5-ethanol, 1-methyl-2-nitro-?
The molecular weight of Imidazole-5-ethanol, 1-methyl-2-nitro- is 171.06 g/mol.
Where can I buy Imidazole-5-ethanol, 1-methyl-2-nitro-?
You can request a quote for Imidazole-5-ethanol, 1-methyl-2-nitro- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Imidazole-5-ethanol, 1-methyl-2-nitro-?
Yes, KEHONG BIO provides custom synthesis services for Imidazole-5-ethanol, 1-methyl-2-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.