Fluoromisonidazole
TL;DR: Fluoromisonidazole (CAS 13551-89-8) is a chemical compound with molecular formula C6H8FN3O3 and molecular weight 189.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-fluoro-3-(2-nitroimidazol-1-yl)propan-2-ol
Also Known As: Fluoromisonidazole, FMISO, 1-fluoromisonidazole, Misonidazole, fluoro-, 18F-Fluoromisonidazole
| Molecular Formula | C6H8FN3O3 |
|---|---|
| Molecular Weight | 189.05 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 83.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 189.05496 |
| Heavy Atoms | 13 |
| Complexity | 186.0 |
Chemical Identifiers
| CAS Number | 13551-89-8 |
|---|---|
| SMILES | C1=CN(C(=N1)[N+](=O)[O-])CC(CF)O |
| InChIKey | HIIJZYSUEJYLMX-UHFFFAOYSA-N |
Product Overview
Fluoromisonidazole (CAS 13551-89-8), with molecular formula C6H8FN3O3 and molecular weight 189.05 g/mol. IUPAC: 1-fluoro-3-(2-nitroimidazol-1-yl)propan-2-ol.
Chemical Property Profile of Fluoromisonidazole
Property Insights of Fluoromisonidazole
The XLogP value of -0.5 indicates that Fluoromisonidazole 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 Fluoromisonidazole. Following Lipinski's Rule of Five, Fluoromisonidazole has 1 hydrogen bond donor(s) and 5 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 Fluoromisonidazole?
The CAS number of Fluoromisonidazole is 13551-89-8.
What is the molecular formula of Fluoromisonidazole?
The molecular formula of Fluoromisonidazole is C6H8FN3O3.
What is the molecular weight of Fluoromisonidazole?
The molecular weight of Fluoromisonidazole is 189.05 g/mol.
Where can I buy Fluoromisonidazole?
You can request a quote for Fluoromisonidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Fluoromisonidazole?
Yes, KEHONG BIO provides custom synthesis services for Fluoromisonidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.