6-Fluoro-4-methyl-3-phenylcoumarin
TL;DR: 6-Fluoro-4-methyl-3-phenylcoumarin (CAS 288399-91-7) is a chemical compound with molecular formula C16H11FO2 and molecular weight 254.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-fluoro-4-methyl-3-phenylchromen-2-one
Also Known As: 6-Fluoro-4-methyl-3-phenylcoumarin, 5,7-Dimethoxyisoflavone, 6-fluoro-4-methyl-3-phenylchromen-2-one, 6-Fluoro-4-methyl-3-phenyl-2H-chromen-2-one, 6-fluoro-4-methyl-3-phenyl-chromen-2-one
| Molecular Formula | C16H11FO2 |
|---|---|
| Molecular Weight | 254.07 g/mol |
| LogP | 3.90752 |
| Topological Polar Surface Area | 30.21 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 254.07431 |
| Heavy Atoms | 19 |
| Complexity | 804.08704 |
Chemical Identifiers
| CAS Number | 288399-91-7 |
|---|---|
| SMILES | CC1=C(C(=O)OC2=C1C=C(C=C2)F)C3=CC=CC=C3 |
Product Overview
6-Fluoro-4-methyl-3-phenylcoumarin (CAS 288399-91-7), with molecular formula C16H11FO2 and molecular weight 254.07 g/mol. IUPAC: 6-fluoro-4-methyl-3-phenylchromen-2-one.
Chemical Property Profile of 6-Fluoro-4-methyl-3-phenylcoumarin
Property Insights of 6-Fluoro-4-methyl-3-phenylcoumarin
The XLogP value of 3.90752 indicates that 6-Fluoro-4-methyl-3-phenylcoumarin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.21 Ų, 6-Fluoro-4-methyl-3-phenylcoumarin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Fluoro-4-methyl-3-phenylcoumarin 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 6-Fluoro-4-methyl-3-phenylcoumarin?
The CAS number of 6-Fluoro-4-methyl-3-phenylcoumarin is 288399-91-7.
What is the molecular formula of 6-Fluoro-4-methyl-3-phenylcoumarin?
The molecular formula of 6-Fluoro-4-methyl-3-phenylcoumarin is C16H11FO2.
What is the molecular weight of 6-Fluoro-4-methyl-3-phenylcoumarin?
The molecular weight of 6-Fluoro-4-methyl-3-phenylcoumarin is 254.07 g/mol.
Where can I buy 6-Fluoro-4-methyl-3-phenylcoumarin?
You can request a quote for 6-Fluoro-4-methyl-3-phenylcoumarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Fluoro-4-methyl-3-phenylcoumarin?
Yes, KEHONG BIO provides custom synthesis services for 6-Fluoro-4-methyl-3-phenylcoumarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.