3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone
TL;DR: 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone (CAS 3950-58-1) is a chemical compound with molecular formula C24H14N4O12S and molecular weight 582.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-nitro-4-[3-nitro-4-(4-nitrophenoxy)phenyl]sulfonyl-1-(4-nitrophenoxy)benzene
Also Known As: 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone, Benzene,1,1-sulfonylbis[3-nitro-4-(4-nitrophenoxy)-, 2-nitro-4-[3-nitro-4-(4-nitrophenoxy)phenyl]sulfonyl-1-(4-nitrophenoxy)benzene, Hydroxy(5-((3-(hydroxy(oxido)amino)-4-(4-(hydroxy(oxido)amino)phenoxy)phenyl)sulfonyl)-2-(4-(hydroxy(oxido)amino)phenoxy)phenyl)azane oxide, 1,1'-{Sulfonylbis[(2-nitro-4,1-phenylene)oxy]}bis(4-nitrobenzene)
| Molecular Formula | C24H14N4O12S |
|---|---|
| Molecular Weight | 582.03 g/mol |
| LogP | 5.1 |
| Topological Polar Surface Area | 244.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 582.0329 |
| Heavy Atoms | 41 |
| Complexity | 985.0 |
Chemical Identifiers
| CAS Number | 3950-58-1 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OC2=C(C=C(C=C2)S(=O)(=O)C3=CC(=C(C=C3)OC4=CC=C(C=C4)[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | VSAVCOJRHGXMCL-UHFFFAOYSA-N |
Product Overview
3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone (CAS 3950-58-1), with molecular formula C24H14N4O12S and molecular weight 582.03 g/mol. IUPAC: 2-nitro-4-[3-nitro-4-(4-nitrophenoxy)phenyl]sulfonyl-1-(4-nitrophenoxy)benzene.
Chemical Property Profile of 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone
Property Insights of 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone
The XLogP value of 5.1 indicates that 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 244.0 Ų indicates high polarity, suggesting 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone has 0 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone?
The CAS number of 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone is 3950-58-1.
What is the molecular formula of 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone?
The molecular formula of 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone is C24H14N4O12S.
What is the molecular weight of 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone?
The molecular weight of 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone is 582.03 g/mol.
Where can I buy 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone?
You can request a quote for 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone?
Yes, KEHONG BIO provides custom synthesis services for 3,3'-dinitro-4,4'-di(p-nitrophenoxy)diphenylsulfone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.