3-Bromo-2-fluoroquinoline
TL;DR: 3-Bromo-2-fluoroquinoline (CAS 179488-06-3) is a chemical compound with molecular formula C9H5BrFN and molecular weight 224.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-2-fluoroquinoline
Also Known As: 3-bromo-2-fluoroquinoline, bromofluoroquinoline, quinoline, 3-bromo-2-fluoro-, 2-Fluoro-3-bromoquinoline, 2fluoro-3-bromoquinoline
| Molecular Formula | C9H5BrFN |
|---|---|
| Molecular Weight | 224.96 g/mol |
| LogP | 3.3 |
| Topological Polar Surface Area | 12.9 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 0 |
| Exact Mass | 224.95894 |
| Heavy Atoms | 12 |
| Complexity | 165.0 |
Chemical Identifiers
| CAS Number | 179488-06-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=C(C(=N2)F)Br |
| InChIKey | TZQPMQWGLQPGLG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Bromo-2-fluoroquinoline (CAS 179488-06-3), with molecular formula C9H5BrFN and molecular weight 224.96 g/mol. IUPAC: 3-bromo-2-fluoroquinoline.
Chemical Property Profile of 3-Bromo-2-fluoroquinoline
Property Insights of 3-Bromo-2-fluoroquinoline
The XLogP value of 3.3 indicates that 3-Bromo-2-fluoroquinoline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.9 Ų, 3-Bromo-2-fluoroquinoline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Bromo-2-fluoroquinoline has 0 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 3-Bromo-2-fluoroquinoline?
The CAS number of 3-Bromo-2-fluoroquinoline is 179488-06-3.
What is the molecular formula of 3-Bromo-2-fluoroquinoline?
The molecular formula of 3-Bromo-2-fluoroquinoline is C9H5BrFN.
What is the molecular weight of 3-Bromo-2-fluoroquinoline?
The molecular weight of 3-Bromo-2-fluoroquinoline is 224.96 g/mol.
Where can I buy 3-Bromo-2-fluoroquinoline?
You can request a quote for 3-Bromo-2-fluoroquinoline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Bromo-2-fluoroquinoline?
Yes, KEHONG BIO provides custom synthesis services for 3-Bromo-2-fluoroquinoline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.