1-Fluoro-3-(4-nitrophenoxy)benzene
TL;DR: 1-Fluoro-3-(4-nitrophenoxy)benzene (CAS 34859-79-5) is a chemical compound with molecular formula C12H8FNO3 and molecular weight 233.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-fluoro-3-(4-nitrophenoxy)benzene
Also Known As: 1-fluoro-3-(4-nitrophenoxy)benzene, 1-fluoro-3-(4-nitrophenoxy)-benzene, 3-fluorophenyl 4-nitrophenyl ether, 1-(3-fluorophenoxy)-4-nitrobenzene, 3-(4-nitrophenoxy)-fluorobenzene
| Molecular Formula | C12H8FNO3 |
|---|---|
| Molecular Weight | 233.05 g/mol |
| LogP | 3.5262 |
| Topological Polar Surface Area | 52.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 233.04883 |
| Heavy Atoms | 17 |
| Complexity | 539.7019 |
Chemical Identifiers
| CAS Number | 34859-79-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)F)OC2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
1-Fluoro-3-(4-nitrophenoxy)benzene (CAS 34859-79-5), with molecular formula C12H8FNO3 and molecular weight 233.05 g/mol. IUPAC: 1-fluoro-3-(4-nitrophenoxy)benzene.
Chemical Property Profile of 1-Fluoro-3-(4-nitrophenoxy)benzene
Property Insights of 1-Fluoro-3-(4-nitrophenoxy)benzene
The XLogP value of 3.5262 indicates that 1-Fluoro-3-(4-nitrophenoxy)benzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.37 Ų, 1-Fluoro-3-(4-nitrophenoxy)benzene exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Fluoro-3-(4-nitrophenoxy)benzene has 0 hydrogen bond donor(s) and 3 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-Fluoro-3-(4-nitrophenoxy)benzene?
The CAS number of 1-Fluoro-3-(4-nitrophenoxy)benzene is 34859-79-5.
What is the molecular formula of 1-Fluoro-3-(4-nitrophenoxy)benzene?
The molecular formula of 1-Fluoro-3-(4-nitrophenoxy)benzene is C12H8FNO3.
What is the molecular weight of 1-Fluoro-3-(4-nitrophenoxy)benzene?
The molecular weight of 1-Fluoro-3-(4-nitrophenoxy)benzene is 233.05 g/mol.
Where can I buy 1-Fluoro-3-(4-nitrophenoxy)benzene?
You can request a quote for 1-Fluoro-3-(4-nitrophenoxy)benzene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Fluoro-3-(4-nitrophenoxy)benzene?
Yes, KEHONG BIO provides custom synthesis services for 1-Fluoro-3-(4-nitrophenoxy)benzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.