3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate
TL;DR: 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate (CAS 302902-30-3) is a chemical compound with molecular formula C18H13FO5 and molecular weight 328.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl] acetate
Also Known As: 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-yl acetate, [3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl] acetate, [3-(4-fluorophenoxy)-2-methyl-4-oxo-chromen-7-yl] Acetate, 652-357-2, RefChem:493031
| Molecular Formula | C18H13FO5 |
|---|---|
| Molecular Weight | 328.07 g/mol |
| LogP | 3.95812 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Exact Mass | 328.0747 |
| Heavy Atoms | 24 |
| Complexity | 973.10596 |
Chemical Identifiers
| CAS Number | 302902-30-3 |
|---|---|
| SMILES | CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C)OC3=CC=C(C=C3)F |
Product Overview
3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate (CAS 302902-30-3), with molecular formula C18H13FO5 and molecular weight 328.07 g/mol. IUPAC: [3-(4-fluorophenoxy)-2-methyl-4-oxochromen-7-yl] acetate.
Chemical Property Profile of 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate
Property Insights of 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate
The XLogP value of 3.95812 indicates that 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate. Following Lipinski's Rule of Five, 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate has 0 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 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate?
The CAS number of 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate is 302902-30-3.
What is the molecular formula of 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate?
The molecular formula of 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate is C18H13FO5.
What is the molecular weight of 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate?
The molecular weight of 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate is 328.07 g/mol.
Where can I buy 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate?
You can request a quote for 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-Fluorophenoxy)-2-methyl-4-oxo-4H-chromen-7-YL acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.