![4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one structure](/static/products/4769/4769-52-2.webp)
4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one
TL;DR: 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one (CAS 4769-52-2) is a chemical compound with molecular formula C22H9Cl5N2O5 and molecular weight 555.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one
Also Known As: 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one, 4-{[3-Nitro-4-(pentachlorophenoxy)phenyl]methylidene}-2-phenyl-1,3-oxazol-5(4H)-one
| Molecular Formula | C22H9Cl5N2O5 |
|---|---|
| Molecular Weight | 555.90 g/mol |
| LogP | 7.9986 |
| Topological Polar Surface Area | 91.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 555.8954 |
| Heavy Atoms | 34 |
| Complexity | 1377.5344 |
Chemical Identifiers
| CAS Number | 4769-52-2 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2=NC(=CC3=CC(=C(C=C3)OC4=C(C(=C(C(=C4Cl)Cl)Cl)Cl)Cl)[N+](=O)[O-])C(=O)O2 |
Product Overview
4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one (CAS 4769-52-2), with molecular formula C22H9Cl5N2O5 and molecular weight 555.90 g/mol. IUPAC: 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one.
Chemical Property Profile of 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one
Property Insights of 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one
The XLogP value of 7.9986 indicates that 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.03 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one. Following Lipinski's Rule of Five, 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one 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 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one?
The CAS number of 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one is 4769-52-2.
What is the molecular formula of 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one?
The molecular formula of 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one is C22H9Cl5N2O5.
What is the molecular weight of 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one?
The molecular weight of 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one is 555.90 g/mol.
Where can I buy 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one?
You can request a quote for 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one?
Yes, KEHONG BIO provides custom synthesis services for 4-[[3-nitro-4-(2,3,4,5,6-pentachlorophenoxy)phenyl]methylidene]-2-phenyl-1,3-oxazol-5-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.