1-Methyl-2-nitro-1H-imidazole-5-methanol
TL;DR: 1-Methyl-2-nitro-1H-imidazole-5-methanol (CAS 39070-14-9) 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.
(3-methyl-2-nitroimidazol-4-yl)methanol
Also Known As: (1-methyl-2-nitro-1h-imidazol-5-yl)methanol, (3-Methyl-2-nitro-3H-imidazol-4-yl)-methanol, 1-methyl-2-nitroimidazole-5-methanol, (3-methyl-2-nitroimidazol-4-yl)methanol, (3-METHYL-2-NITRO-3H-IMIDAZOL-4-YL)METHANOL
| Molecular Formula | C5H7N3O3 |
|---|---|
| Molecular Weight | 157.05 g/mol |
| LogP | -0.4 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 157.04874 |
| Heavy Atoms | 11 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 39070-14-9 |
|---|---|
| SMILES | CN1C(=CN=C1[N+](=O)[O-])CO |
| InChIKey | WXSSUDRHAJTESR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Methyl-2-nitro-1H-imidazole-5-methanol (CAS 39070-14-9), with molecular formula C5H7N3O3 and molecular weight 157.05 g/mol. IUPAC: (3-methyl-2-nitroimidazol-4-yl)methanol.
Chemical Property Profile of 1-Methyl-2-nitro-1H-imidazole-5-methanol
Property Insights of 1-Methyl-2-nitro-1H-imidazole-5-methanol
The XLogP value of -0.4 indicates that 1-Methyl-2-nitro-1H-imidazole-5-methanol 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 1-Methyl-2-nitro-1H-imidazole-5-methanol. Following Lipinski's Rule of Five, 1-Methyl-2-nitro-1H-imidazole-5-methanol 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 1-Methyl-2-nitro-1H-imidazole-5-methanol?
The CAS number of 1-Methyl-2-nitro-1H-imidazole-5-methanol is 39070-14-9.
What is the molecular formula of 1-Methyl-2-nitro-1H-imidazole-5-methanol?
The molecular formula of 1-Methyl-2-nitro-1H-imidazole-5-methanol is C5H7N3O3.
What is the molecular weight of 1-Methyl-2-nitro-1H-imidazole-5-methanol?
The molecular weight of 1-Methyl-2-nitro-1H-imidazole-5-methanol is 157.05 g/mol.
Where can I buy 1-Methyl-2-nitro-1H-imidazole-5-methanol?
You can request a quote for 1-Methyl-2-nitro-1H-imidazole-5-methanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Methyl-2-nitro-1H-imidazole-5-methanol?
Yes, KEHONG BIO provides custom synthesis services for 1-Methyl-2-nitro-1H-imidazole-5-methanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.