Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate
TL;DR: Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate (CAS 577762-77-7) is a chemical compound with molecular formula C24H16ClFO6 and molecular weight 454.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 4-[7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yl]oxybenzoate
Also Known As: methyl 4-((7-((2-chloro-6-fluorobenzyl)oxy)-4-oxo-4H-chromen-3-yl)oxy)benzoate, methyl 4-({7-[(2-chloro-6-fluorobenzyl)oxy]-4-oxo-4H-chromen-3-yl}oxy)benzoate, Methyl 4-[7-[(2-chloro-6-fluoro-phenyl)methoxy]-4-oxo-chromen-3-yl]oxybenzoate, methyl 4-[7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yl]oxybenzoate, methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate
| Molecular Formula | C24H16ClFO6 |
|---|---|
| Molecular Weight | 454.06 g/mol |
| LogP | 5.7434 |
| Topological Polar Surface Area | 74.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 454.06195 |
| Heavy Atoms | 32 |
| Complexity | 1326.9523 |
Chemical Identifiers
| CAS Number | 577762-77-7 |
|---|---|
| SMILES | COC(=O)C1=CC=C(C=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC4=C(C=CC=C4Cl)F |
Product Overview
Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate (CAS 577762-77-7), with molecular formula C24H16ClFO6 and molecular weight 454.06 g/mol. IUPAC: methyl 4-[7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yl]oxybenzoate.
Chemical Property Profile of Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate
Property Insights of Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate
The XLogP value of 5.7434 indicates that Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 74.97 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate. Following Lipinski's Rule of Five, Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate?
The CAS number of Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate is 577762-77-7.
What is the molecular formula of Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate?
The molecular formula of Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate is C24H16ClFO6.
What is the molecular weight of Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate?
The molecular weight of Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate is 454.06 g/mol.
Where can I buy Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate?
You can request a quote for Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 4-{7-[(2-chloro-6-fluorophenyl)methoxy]-4-oxochromen-3-yloxy}benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.