3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one
TL;DR: 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one (CAS 902015-76-3) is a chemical compound with molecular formula C21H15FO4 and molecular weight 350.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(4-fluorophenyl)methoxy]-1-hydroxy-5-methylxanthen-9-one
Also Known As: 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one, 3-[(4-fluorobenzyl)oxy]-1-hydroxy-5-methyl-9H-xanthen-9-one, 3-[(4-fluorophenyl)methoxy]-1-hydroxy-5-methylxanthen-9-one
| Molecular Formula | C21H15FO4 |
|---|---|
| Molecular Weight | 350.10 g/mol |
| LogP | 4.67832 |
| Topological Polar Surface Area | 59.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 350.09543 |
| Heavy Atoms | 26 |
| Complexity | 1176.6871 |
Chemical Identifiers
| CAS Number | 902015-76-3 |
|---|---|
| SMILES | CC1=C2C(=CC=C1)C(=O)C3=C(C=C(C=C3O2)OCC4=CC=C(C=C4)F)O |
Product Overview
3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one (CAS 902015-76-3), with molecular formula C21H15FO4 and molecular weight 350.10 g/mol. IUPAC: 3-[(4-fluorophenyl)methoxy]-1-hydroxy-5-methylxanthen-9-one.
Chemical Property Profile of 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one
Property Insights of 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one
The XLogP value of 4.67832 indicates that 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.67 Ų, 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one has 1 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 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one?
The CAS number of 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one is 902015-76-3.
What is the molecular formula of 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one?
The molecular formula of 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one is C21H15FO4.
What is the molecular weight of 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one?
The molecular weight of 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one is 350.10 g/mol.
Where can I buy 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one?
You can request a quote for 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one?
Yes, KEHONG BIO provides custom synthesis services for 3-((4-fluorobenzyl)oxy)-1-hydroxy-5-methyl-9H-xanthen-9-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.