C22H19Cl2FO5
TL;DR: C22H19Cl2FO5 (CAS 578698-22-3) is a chemical compound with molecular formula C22H19Cl2FO5 and molecular weight 452.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-[6-chloro-7-[(2-chloro-6-fluorophenyl)methoxy]-4-methyl-2-oxochromen-3-yl]propanoate
Also Known As: ethyl 3-{6-chloro-7-[(2-chloro-6-fluorobenzyl)oxy]-4-methyl-2-oxo-2H-chromen-3-yl}propanoate, ethyl 3-(6-chloro-7-((2-chloro-6-fluorobenzyl)oxy)-4-methyl-2-oxo-2H-chromen-3-yl)propanoate, Ethyl 3-[6-chloro-7-[(2-chloro-6-fluoro-phenyl)methoxy]-4-methyl-2-oxo-chromen-3-yl]propanoate, ethyl 3-[6-chloro-7-[(2-chloro-6-fluorophenyl)methoxy]-4-methyl-2-oxochromen-3-yl]propanoate, ETHYL 3-{6-CHLORO-7-[(2-CHLORO-6-FLUOROPHENYL)METHOXY]-4-METHYL-2-OXO-2H-CHROMEN-3-YL}PROPANOATE
| Molecular Formula | C22H19Cl2FO5 |
|---|---|
| Molecular Weight | 452.06 g/mol |
| LogP | 5.62202 |
| Topological Polar Surface Area | 65.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 452.05936 |
| Heavy Atoms | 30 |
| Complexity | 1136.2035 |
Chemical Identifiers
| CAS Number | 578698-22-3 |
|---|---|
| SMILES | CCOC(=O)CCC1=C(C2=CC(=C(C=C2OC1=O)OCC3=C(C=CC=C3Cl)F)Cl)C |
Product Overview
C22H19Cl2FO5 (CAS 578698-22-3), with molecular formula C22H19Cl2FO5 and molecular weight 452.06 g/mol. IUPAC: ethyl 3-[6-chloro-7-[(2-chloro-6-fluorophenyl)methoxy]-4-methyl-2-oxochromen-3-yl]propanoate.
Chemical Property Profile of C22H19Cl2FO5
Property Insights of C22H19Cl2FO5
The XLogP value of 5.62202 indicates that C22H19Cl2FO5 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 C22H19Cl2FO5. Following Lipinski's Rule of Five, C22H19Cl2FO5 has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C22H19Cl2FO5?
The CAS number of C22H19Cl2FO5 is 578698-22-3.
What is the molecular formula of C22H19Cl2FO5?
The molecular formula of C22H19Cl2FO5 is C22H19Cl2FO5.
What is the molecular weight of C22H19Cl2FO5?
The molecular weight of C22H19Cl2FO5 is 452.06 g/mol.
Where can I buy C22H19Cl2FO5?
You can request a quote for C22H19Cl2FO5 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C22H19Cl2FO5?
Yes, KEHONG BIO provides custom synthesis services for C22H19Cl2FO5 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.