![[3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate structure](/static/products/4310/431073-66-4.webp)
[3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate
TL;DR: [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate (CAS 431073-66-4) is a chemical compound with molecular formula C23H11ClF3NO6 and molecular weight 489.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate
Also Known As: [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate|3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate|3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl 4-nitrobenzoate
| Molecular Formula | C23H11ClF3NO6 |
|---|---|
| Molecular Weight | 489.02 g/mol |
| LogP | 6.2596 |
| Topological Polar Surface Area | 99.65 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 489.0227 |
| Heavy Atoms | 34 |
| Complexity | 1478.5955 |
Chemical Identifiers
| CAS Number | 431073-66-4 |
|---|---|
| SMILES | C1=CC(=CC=C1C2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F)Cl |
Product Overview
[3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate (CAS 431073-66-4), with molecular formula C23H11ClF3NO6 and molecular weight 489.02 g/mol. IUPAC: [3-(4-chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate.
Chemical Property Profile of [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate
Property Insights of [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate
The XLogP value of 6.2596 indicates that [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 99.65 Ų falls within the moderate polarity range, balancing permeability and solubility for [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate. Following Lipinski's Rule of Five, [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate 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 [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate?
The CAS number of [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate is 431073-66-4.
What is the molecular formula of [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate?
The molecular formula of [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate is C23H11ClF3NO6.
What is the molecular weight of [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate?
The molecular weight of [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate is 489.02 g/mol.
Where can I buy [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate?
You can request a quote for [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for [3-(4-Chlorophenyl)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.