6-Fluoro-2H-chromen-2-one
TL;DR: 6-Fluoro-2H-chromen-2-one (CAS 75487-82-0) is a chemical compound with molecular formula C9H5FO2 and molecular weight 164.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-fluorochromen-2-one
Also Known As: 6-Fluoro-2H-chromen-2-one, 6-Fluorocoumarin, 6-fluorocoumarine, 6-fluorochromen-2-one, 2H-1-Benzopyran-2-one, 6-fluoro-
| Molecular Formula | C9H5FO2 |
|---|---|
| Molecular Weight | 164.03 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 26.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 164.02736 |
| Heavy Atoms | 12 |
| Complexity | 225.0 |
Chemical Identifiers
| CAS Number | 75487-82-0 |
|---|---|
| SMILES | C1=CC2=C(C=CC(=O)O2)C=C1F |
| InChIKey | WBUWUULCBSNTNA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Fluoro-2H-chromen-2-one (CAS 75487-82-0), with molecular formula C9H5FO2 and molecular weight 164.03 g/mol. IUPAC: 6-fluorochromen-2-one.
Chemical Property Profile of 6-Fluoro-2H-chromen-2-one
Property Insights of 6-Fluoro-2H-chromen-2-one
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Fluoro-2H-chromen-2-one. With a topological polar surface area (TPSA) of 26.3 Ų, 6-Fluoro-2H-chromen-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Fluoro-2H-chromen-2-one has 0 hydrogen bond donor(s) and 3 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 6-Fluoro-2H-chromen-2-one?
The CAS number of 6-Fluoro-2H-chromen-2-one is 75487-82-0.
What is the molecular formula of 6-Fluoro-2H-chromen-2-one?
The molecular formula of 6-Fluoro-2H-chromen-2-one is C9H5FO2.
What is the molecular weight of 6-Fluoro-2H-chromen-2-one?
The molecular weight of 6-Fluoro-2H-chromen-2-one is 164.03 g/mol.
Where can I buy 6-Fluoro-2H-chromen-2-one?
You can request a quote for 6-Fluoro-2H-chromen-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Fluoro-2H-chromen-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-Fluoro-2H-chromen-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.