1H-Imidazole-1-ethanol, 5-methyl-2-nitro-
TL;DR: 1H-Imidazole-1-ethanol, 5-methyl-2-nitro- (CAS 23571-38-2) 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-(5-methyl-2-nitroimidazol-1-yl)ethanol
Also Known As: 5-Methyl-2-nitroimidazole-1-ethanol, 1H-Imidazole-1-ethanol, 5-methyl-2-nitro-, Imidazole-1-ethanol, 5-methyl-2-nitro-, 2-(5-methyl-2-nitroimidazol-1-yl)ethanol, 2-Nitro-5-methyl-1H-imidazole-1-ethanol
| Molecular Formula | C6H9N3O3 |
|---|---|
| Molecular Weight | 171.06 g/mol |
| LogP | 0.2 |
| 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 | 23571-38-2 |
|---|---|
| SMILES | CC1=CN=C(N1CCO)[N+](=O)[O-] |
| InChIKey | FIIUIEQMEKWLPT-UHFFFAOYSA-N |
Product Overview
1H-Imidazole-1-ethanol, 5-methyl-2-nitro- (CAS 23571-38-2), with molecular formula C6H9N3O3 and molecular weight 171.06 g/mol. IUPAC: 2-(5-methyl-2-nitroimidazol-1-yl)ethanol.
Chemical Property Profile of 1H-Imidazole-1-ethanol, 5-methyl-2-nitro-
Property Insights of 1H-Imidazole-1-ethanol, 5-methyl-2-nitro-
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1H-Imidazole-1-ethanol, 5-methyl-2-nitro-. The TPSA of 83.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 1H-Imidazole-1-ethanol, 5-methyl-2-nitro-. Following Lipinski's Rule of Five, 1H-Imidazole-1-ethanol, 5-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 1H-Imidazole-1-ethanol, 5-methyl-2-nitro-?
The CAS number of 1H-Imidazole-1-ethanol, 5-methyl-2-nitro- is 23571-38-2.
What is the molecular formula of 1H-Imidazole-1-ethanol, 5-methyl-2-nitro-?
The molecular formula of 1H-Imidazole-1-ethanol, 5-methyl-2-nitro- is C6H9N3O3.
What is the molecular weight of 1H-Imidazole-1-ethanol, 5-methyl-2-nitro-?
The molecular weight of 1H-Imidazole-1-ethanol, 5-methyl-2-nitro- is 171.06 g/mol.
Where can I buy 1H-Imidazole-1-ethanol, 5-methyl-2-nitro-?
You can request a quote for 1H-Imidazole-1-ethanol, 5-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 1H-Imidazole-1-ethanol, 5-methyl-2-nitro-?
Yes, KEHONG BIO provides custom synthesis services for 1H-Imidazole-1-ethanol, 5-methyl-2-nitro- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.