![1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene structure](/static/products/4780/478039-83-7.webp)
1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene
TL;DR: 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene (CAS 478039-83-7) is a chemical compound with molecular formula C19H13BrFNO4 and molecular weight 417.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-bromo-1-(3-fluoro-4-phenylmethoxyphenoxy)-4-nitrobenzene
Also Known As: 1-[4-(benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene, 2-bromo-1-(3-fluoro-4-phenylmethoxyphenoxy)-4-nitrobenzene, 3R-0206, 4-(2-bromo-4-nitro-phenoxy)-2-fluoro-1-phenylmethoxy-benzene, 4-(2-Bromo-4-nitrophenoxy)-2-fluoro-1-(phenylmethoxy)benzene
| Molecular Formula | C19H13BrFNO4 |
|---|---|
| Molecular Weight | 417.00 g/mol |
| LogP | 5.8677 |
| Topological Polar Surface Area | 61.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.0012 |
| Heavy Atoms | 26 |
| Complexity | 934.07715 |
Chemical Identifiers
| CAS Number | 478039-83-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)COC2=C(C=C(C=C2)OC3=C(C=C(C=C3)[N+](=O)[O-])Br)F |
Product Overview
1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene (CAS 478039-83-7), with molecular formula C19H13BrFNO4 and molecular weight 417.00 g/mol. IUPAC: 2-bromo-1-(3-fluoro-4-phenylmethoxyphenoxy)-4-nitrobenzene.
Chemical Property Profile of 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene
Property Insights of 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene
The XLogP value of 5.8677 indicates that 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 61.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene. Following Lipinski's Rule of Five, 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene?
The CAS number of 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene is 478039-83-7.
What is the molecular formula of 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene?
The molecular formula of 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene is C19H13BrFNO4.
What is the molecular weight of 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene?
The molecular weight of 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene is 417.00 g/mol.
Where can I buy 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene?
You can request a quote for 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-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-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(Benzyloxy)-3-fluorophenoxy]-2-bromo-4-nitrobenzene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.