1,1'-Oxybis(4-nitrobenzene)
TL;DR: 1,1'-Oxybis(4-nitrobenzene) (CAS 101-63-3) is a chemical compound with molecular formula C12H8N2O5 and molecular weight 260.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-nitro-4-(4-nitrophenoxy)benzene
Also Known As: 4,4'-Dinitrodiphenyl ether, p-Nitrophenyl ether, Bis(4-nitrophenyl) ether, Di-4-nitrophenyl ether, 4,4'-Oxybis(nitrobenzene)
| Molecular Formula | C12H8N2O5 |
|---|---|
| Molecular Weight | 260.04 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 260.04333 |
| Heavy Atoms | 19 |
| Complexity | 290.0 |
Chemical Identifiers
| CAS Number | 101-63-3 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OC2=CC=C(C=C2)[N+](=O)[O-] |
| InChIKey | MWAGUKZCDDRDCS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,1'-Oxybis(4-nitrobenzene) (CAS 101-63-3), with molecular formula C12H8N2O5 and molecular weight 260.04 g/mol. IUPAC: 1-nitro-4-(4-nitrophenoxy)benzene.
Chemical Property Profile of 1,1'-Oxybis(4-nitrobenzene)
Property Insights of 1,1'-Oxybis(4-nitrobenzene)
The XLogP value of 3.7 indicates that 1,1'-Oxybis(4-nitrobenzene) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1,1'-Oxybis(4-nitrobenzene). Following Lipinski's Rule of Five, 1,1'-Oxybis(4-nitrobenzene) has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,1'-Oxybis(4-nitrobenzene)?
The CAS number of 1,1'-Oxybis(4-nitrobenzene) is 101-63-3.
What is the molecular formula of 1,1'-Oxybis(4-nitrobenzene)?
The molecular formula of 1,1'-Oxybis(4-nitrobenzene) is C12H8N2O5.
What is the molecular weight of 1,1'-Oxybis(4-nitrobenzene)?
The molecular weight of 1,1'-Oxybis(4-nitrobenzene) is 260.04 g/mol.
Where can I buy 1,1'-Oxybis(4-nitrobenzene)?
You can request a quote for 1,1'-Oxybis(4-nitrobenzene) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1'-Oxybis(4-nitrobenzene)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Oxybis(4-nitrobenzene) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.