4-Fluoroimidazole
TL;DR: 4-Fluoroimidazole (CAS 30086-17-0) is a chemical compound with molecular formula C3H3FN2 and molecular weight 86.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-fluoro-1H-imidazole
Also Known As: 4-Fluoro-1H-imidazole, 5-fluoro-1H-imidazole, 4-Fluoroimidazole, 5-Fluoroimidazole, 1-2 weeks
| Molecular Formula | C3H3FN2 |
|---|---|
| Molecular Weight | 86.03 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 28.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 86.02802 |
| Heavy Atoms | 6 |
| Complexity | 48.0 |
Chemical Identifiers
| CAS Number | 30086-17-0 |
|---|---|
| SMILES | C1=C(NC=N1)F |
| InChIKey | HWUPTWDARIVICI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Fluoroimidazole (CAS 30086-17-0), with molecular formula C3H3FN2 and molecular weight 86.03 g/mol. IUPAC: 5-fluoro-1H-imidazole.
Chemical Property Profile of 4-Fluoroimidazole
Property Insights of 4-Fluoroimidazole
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Fluoroimidazole. With a topological polar surface area (TPSA) of 28.7 Ų, 4-Fluoroimidazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Fluoroimidazole has 1 hydrogen bond donor(s) and 2 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 4-Fluoroimidazole?
The CAS number of 4-Fluoroimidazole is 30086-17-0.
What is the molecular formula of 4-Fluoroimidazole?
The molecular formula of 4-Fluoroimidazole is C3H3FN2.
What is the molecular weight of 4-Fluoroimidazole?
The molecular weight of 4-Fluoroimidazole is 86.03 g/mol.
Where can I buy 4-Fluoroimidazole?
You can request a quote for 4-Fluoroimidazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Fluoroimidazole?
Yes, KEHONG BIO provides custom synthesis services for 4-Fluoroimidazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.