5-Fluoro-2-nitroanisole
TL;DR: 5-Fluoro-2-nitroanisole (CAS 448-19-1) is a chemical compound with molecular formula C7H6FNO3 and molecular weight 171.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-fluoro-2-methoxy-1-nitrobenzene
Also Known As: 5-Fluoro-2-nitroanisole, 4-Fluoro-2-methoxy-1-nitrobenzene, 3-fluoro-6-nitroanisole, 2-Nitro-5-fluoroanisole, ALPHAPRODINE
| Molecular Formula | C7H6FNO3 |
|---|---|
| Molecular Weight | 171.03 g/mol |
| LogP | 1.7425 |
| Topological Polar Surface Area | 52.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 171.03317 |
| Heavy Atoms | 12 |
| Complexity | 313.51984 |
Chemical Identifiers
| CAS Number | 448-19-1 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)F)[N+](=O)[O-] |
Product Overview
5-Fluoro-2-nitroanisole (CAS 448-19-1), with molecular formula C7H6FNO3 and molecular weight 171.03 g/mol. IUPAC: 4-fluoro-2-methoxy-1-nitrobenzene.
Chemical Property Profile of 5-Fluoro-2-nitroanisole
Property Insights of 5-Fluoro-2-nitroanisole
The XLogP value of 1.7425 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-Fluoro-2-nitroanisole. With a topological polar surface area (TPSA) of 52.37 Ų, 5-Fluoro-2-nitroanisole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Fluoro-2-nitroanisole 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 5-Fluoro-2-nitroanisole?
The CAS number of 5-Fluoro-2-nitroanisole is 448-19-1.
What is the molecular formula of 5-Fluoro-2-nitroanisole?
The molecular formula of 5-Fluoro-2-nitroanisole is C7H6FNO3.
What is the molecular weight of 5-Fluoro-2-nitroanisole?
The molecular weight of 5-Fluoro-2-nitroanisole is 171.03 g/mol.
Where can I buy 5-Fluoro-2-nitroanisole?
You can request a quote for 5-Fluoro-2-nitroanisole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Fluoro-2-nitroanisole?
Yes, KEHONG BIO provides custom synthesis services for 5-Fluoro-2-nitroanisole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.