1,1'-Oxybis(4-bromo-2-nitrobenzene)
TL;DR: 1,1'-Oxybis(4-bromo-2-nitrobenzene) (CAS 89798-48-1) is a chemical compound with molecular formula C12H6Br2N2O5 and molecular weight 415.86 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-1-(4-bromo-2-nitrophenoxy)-2-nitrobenzene
Also Known As: 1,1'-oxybis(4-bromo-2-nitrobenzene), KST-1B9086, 4-bromo-1-(4-bromo-2-nitrophenoxy)-2-nitrobenzene
| Molecular Formula | C12H6Br2N2O5 |
|---|---|
| Molecular Weight | 415.86 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 415.86435 |
| Heavy Atoms | 21 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 89798-48-1 |
|---|---|
| SMILES | C1=CC(=C(C=C1Br)[N+](=O)[O-])OC2=C(C=C(C=C2)Br)[N+](=O)[O-] |
| InChIKey | CNWGHUMFQXLORJ-UHFFFAOYSA-N |
Product Overview
1,1'-Oxybis(4-bromo-2-nitrobenzene) (CAS 89798-48-1), with molecular formula C12H6Br2N2O5 and molecular weight 415.86 g/mol. IUPAC: 4-bromo-1-(4-bromo-2-nitrophenoxy)-2-nitrobenzene.
Chemical Property Profile of 1,1'-Oxybis(4-bromo-2-nitrobenzene)
Property Insights of 1,1'-Oxybis(4-bromo-2-nitrobenzene)
The XLogP value of 4.5 indicates that 1,1'-Oxybis(4-bromo-2-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-bromo-2-nitrobenzene). Following Lipinski's Rule of Five, 1,1'-Oxybis(4-bromo-2-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-bromo-2-nitrobenzene)?
The CAS number of 1,1'-Oxybis(4-bromo-2-nitrobenzene) is 89798-48-1.
What is the molecular formula of 1,1'-Oxybis(4-bromo-2-nitrobenzene)?
The molecular formula of 1,1'-Oxybis(4-bromo-2-nitrobenzene) is C12H6Br2N2O5.
What is the molecular weight of 1,1'-Oxybis(4-bromo-2-nitrobenzene)?
The molecular weight of 1,1'-Oxybis(4-bromo-2-nitrobenzene) is 415.86 g/mol.
Where can I buy 1,1'-Oxybis(4-bromo-2-nitrobenzene)?
You can request a quote for 1,1'-Oxybis(4-bromo-2-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-bromo-2-nitrobenzene)?
Yes, KEHONG BIO provides custom synthesis services for 1,1'-Oxybis(4-bromo-2-nitrobenzene) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.