(2-Oxochromen-4-yl) 4-fluorobenzoate
TL;DR: (2-Oxochromen-4-yl) 4-fluorobenzoate (CAS 692275-14-2) is a chemical compound with molecular formula C16H9FO4 and molecular weight 284.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-oxochromen-4-yl) 4-fluorobenzoate
Also Known As: (2-oxochromen-4-yl) 4-fluorobenzoate, 2-oxo-2H-chromen-4-yl 4-fluorobenzoate
| Molecular Formula | C16H9FO4 |
|---|---|
| Molecular Weight | 284.05 g/mol |
| LogP | 3.1513 |
| Topological Polar Surface Area | 56.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.0485 |
| Heavy Atoms | 21 |
| Complexity | 865.3294 |
Chemical Identifiers
| CAS Number | 692275-14-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CC(=O)O2)OC(=O)C3=CC=C(C=C3)F |
Product Overview
(2-Oxochromen-4-yl) 4-fluorobenzoate (CAS 692275-14-2), with molecular formula C16H9FO4 and molecular weight 284.05 g/mol. IUPAC: (2-oxochromen-4-yl) 4-fluorobenzoate.
Chemical Property Profile of (2-Oxochromen-4-yl) 4-fluorobenzoate
Property Insights of (2-Oxochromen-4-yl) 4-fluorobenzoate
The XLogP value of 3.1513 indicates that (2-Oxochromen-4-yl) 4-fluorobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.51 Ų, (2-Oxochromen-4-yl) 4-fluorobenzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2-Oxochromen-4-yl) 4-fluorobenzoate has 0 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 (2-Oxochromen-4-yl) 4-fluorobenzoate?
The CAS number of (2-Oxochromen-4-yl) 4-fluorobenzoate is 692275-14-2.
What is the molecular formula of (2-Oxochromen-4-yl) 4-fluorobenzoate?
The molecular formula of (2-Oxochromen-4-yl) 4-fluorobenzoate is C16H9FO4.
What is the molecular weight of (2-Oxochromen-4-yl) 4-fluorobenzoate?
The molecular weight of (2-Oxochromen-4-yl) 4-fluorobenzoate is 284.05 g/mol.
Where can I buy (2-Oxochromen-4-yl) 4-fluorobenzoate?
You can request a quote for (2-Oxochromen-4-yl) 4-fluorobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Oxochromen-4-yl) 4-fluorobenzoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Oxochromen-4-yl) 4-fluorobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.