6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin
TL;DR: 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin (CAS 527751-33-3) is a chemical compound with molecular formula C17H13FO3 and molecular weight 284.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-fluoro-3-(4-methoxyphenyl)-4-methylchromen-2-one
Also Known As: 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin, 6-fluoro-3-(4-methoxyphenyl)-4-methylchromen-2-one, 6-fluoro-3-(4-methoxyphenyl)-4-methyl-chromen-2-one
| Molecular Formula | C17H13FO3 |
|---|---|
| Molecular Weight | 284.08 g/mol |
| LogP | 3.91612 |
| Topological Polar Surface Area | 39.44 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 284.08487 |
| Heavy Atoms | 21 |
| Complexity | 863.5779 |
Chemical Identifiers
| CAS Number | 527751-33-3 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=C(C=C2)F)C3=CC=C(C=C3)OC |
Product Overview
6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin (CAS 527751-33-3), with molecular formula C17H13FO3 and molecular weight 284.08 g/mol. IUPAC: 6-fluoro-3-(4-methoxyphenyl)-4-methylchromen-2-one.
Chemical Property Profile of 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin
Property Insights of 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin
The XLogP value of 3.91612 indicates that 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.44 Ų, 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin 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-3-(4-methoxyphenyl)-4-methylcoumarin?
The CAS number of 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin is 527751-33-3.
What is the molecular formula of 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin?
The molecular formula of 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin is C17H13FO3.
What is the molecular weight of 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin?
The molecular weight of 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin is 284.08 g/mol.
Where can I buy 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin?
You can request a quote for 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin?
Yes, KEHONG BIO provides custom synthesis services for 6-Fluoro-3-(4-methoxyphenyl)-4-methylcoumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.