1-(4-Fluorophenoxy)-2,4-dinitrobenzene
TL;DR: 1-(4-Fluorophenoxy)-2,4-dinitrobenzene (CAS 103427-45-8) is a chemical compound with molecular formula C12H7FN2O5 and molecular weight 278.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(4-fluorophenoxy)-2,4-dinitrobenzene
Also Known As: 1-(4-fluorophenoxy)-2,4-dinitrobenzene, 2,4-Dinitro-4'-fluorodiphenyl ether, NCIOpen2_006954, Benzene,1-(4-fluorophenoxy)-2,4-dinitro-, 2,4-dinitrophenyl 4-fluorophenyl ether
| Molecular Formula | C12H7FN2O5 |
|---|---|
| Molecular Weight | 278.03 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 278.0339 |
| Heavy Atoms | 20 |
| Complexity | 362.0 |
Chemical Identifiers
| CAS Number | 103427-45-8 |
|---|---|
| SMILES | C1=CC(=CC=C1OC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])F |
| InChIKey | ZKMOMHWTRWMDBT-UHFFFAOYSA-N |
Product Overview
1-(4-Fluorophenoxy)-2,4-dinitrobenzene (CAS 103427-45-8), with molecular formula C12H7FN2O5 and molecular weight 278.03 g/mol. IUPAC: 1-(4-fluorophenoxy)-2,4-dinitrobenzene.
Chemical Property Profile of 1-(4-Fluorophenoxy)-2,4-dinitrobenzene
Property Insights of 1-(4-Fluorophenoxy)-2,4-dinitrobenzene
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Fluorophenoxy)-2,4-dinitrobenzene. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(4-Fluorophenoxy)-2,4-dinitrobenzene. Following Lipinski's Rule of Five, 1-(4-Fluorophenoxy)-2,4-dinitrobenzene has 0 hydrogen bond donor(s) and 6 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-(4-Fluorophenoxy)-2,4-dinitrobenzene?
The CAS number of 1-(4-Fluorophenoxy)-2,4-dinitrobenzene is 103427-45-8.
What is the molecular formula of 1-(4-Fluorophenoxy)-2,4-dinitrobenzene?
The molecular formula of 1-(4-Fluorophenoxy)-2,4-dinitrobenzene is C12H7FN2O5.
What is the molecular weight of 1-(4-Fluorophenoxy)-2,4-dinitrobenzene?
The molecular weight of 1-(4-Fluorophenoxy)-2,4-dinitrobenzene is 278.03 g/mol.
Where can I buy 1-(4-Fluorophenoxy)-2,4-dinitrobenzene?
You can request a quote for 1-(4-Fluorophenoxy)-2,4-dinitrobenzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Fluorophenoxy)-2,4-dinitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Fluorophenoxy)-2,4-dinitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.