3,5-Dinitrophenyl phenyl ether
TL;DR: 3,5-Dinitrophenyl phenyl ether (CAS 148749-61-5) 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.
1,3-dinitro-5-phenoxybenzene
Also Known As: 1,3-dinitro-5-phenoxybenzene, 3,5-dinitrophenyl phenyl ether, 1-Phenoxy-3,5-dinitrobenzene, Phenyl(3,5-dinitrophenyl) ether
| Molecular Formula | C12H8N2O5 |
|---|---|
| Molecular Weight | 260.04 g/mol |
| LogP | 3.2953 |
| Topological Polar Surface Area | 95.51 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.04333 |
| Heavy Atoms | 19 |
| Complexity | 595.0218 |
Chemical Identifiers
| CAS Number | 148749-61-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
3,5-Dinitrophenyl phenyl ether (CAS 148749-61-5), with molecular formula C12H8N2O5 and molecular weight 260.04 g/mol. IUPAC: 1,3-dinitro-5-phenoxybenzene.
Chemical Property Profile of 3,5-Dinitrophenyl phenyl ether
Property Insights of 3,5-Dinitrophenyl phenyl ether
The XLogP value of 3.2953 indicates that 3,5-Dinitrophenyl phenyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,5-Dinitrophenyl phenyl ether. Following Lipinski's Rule of Five, 3,5-Dinitrophenyl phenyl ether 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 3,5-Dinitrophenyl phenyl ether?
The CAS number of 3,5-Dinitrophenyl phenyl ether is 148749-61-5.
What is the molecular formula of 3,5-Dinitrophenyl phenyl ether?
The molecular formula of 3,5-Dinitrophenyl phenyl ether is C12H8N2O5.
What is the molecular weight of 3,5-Dinitrophenyl phenyl ether?
The molecular weight of 3,5-Dinitrophenyl phenyl ether is 260.04 g/mol.
Where can I buy 3,5-Dinitrophenyl phenyl ether?
You can request a quote for 3,5-Dinitrophenyl phenyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,5-Dinitrophenyl phenyl ether?
Yes, KEHONG BIO provides custom synthesis services for 3,5-Dinitrophenyl phenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.