3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate
TL;DR: 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate (CAS 308299-68-5) is a chemical compound with molecular formula C24H14F3NO8 and molecular weight 501.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate
Also Known As: 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate, AP-906/40928161, [3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate, 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl 4-nitrobenzoate
| Molecular Formula | C24H14F3NO8 |
|---|---|
| Molecular Weight | 501.07 g/mol |
| LogP | 5.7401 |
| Topological Polar Surface Area | 118.11 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 501.06714 |
| Heavy Atoms | 36 |
| Complexity | 1510.4106 |
Chemical Identifiers
| CAS Number | 308299-68-5 |
|---|---|
| SMILES | COC1=CC=C(C=C1)OC2=C(OC3=C(C2=O)C=CC(=C3)OC(=O)C4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F |
Product Overview
3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate (CAS 308299-68-5), with molecular formula C24H14F3NO8 and molecular weight 501.07 g/mol. IUPAC: [3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)chromen-7-yl] 4-nitrobenzoate.
Chemical Property Profile of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate
Property Insights of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate
The XLogP value of 5.7401 indicates that 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.11 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate. Following Lipinski's Rule of Five, 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate has 0 hydrogen bond donor(s) and 8 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-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate?
The CAS number of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate is 308299-68-5.
What is the molecular formula of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate?
The molecular formula of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate is C24H14F3NO8.
What is the molecular weight of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate?
The molecular weight of 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate is 501.07 g/mol.
Where can I buy 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate?
You can request a quote for 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-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-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 3-(4-methoxyphenoxy)-4-oxo-2-(trifluoromethyl)-4H-chromen-7-yl 4-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.