![4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol structure](/static/products/868/868256-48-8.png)
4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol
TL;DR: 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol (CAS 868256-48-8) is a chemical compound with molecular formula C13H10BrFN2O3 and molecular weight 339.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-2-[(4-fluoro-3-nitroanilino)methyl]phenol
Also Known As: 4-bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol, 4-bromo-2-[(4-fluoro-3-nitroanilino)methyl]phenol, 4-bromo-2-{[(4-fluoro-3-nitrophenyl)amino]methyl}phenol, 4-Bromo-2-(4-fluoro-3-nitroanilino)methylbenzenol, 4-bromo-2-[(4-fluoro-3-nitro-anilino)methyl]phenol
| Molecular Formula | C13H10BrFN2O3 |
|---|---|
| Molecular Weight | 339.99 g/mol |
| LogP | 3.8141 |
| Topological Polar Surface Area | 75.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 339.98587 |
| Heavy Atoms | 20 |
| Complexity | 664.0597 |
Chemical Identifiers
| CAS Number | 868256-48-8 |
|---|---|
| SMILES | C1=CC(=C(C=C1NCC2=C(C=CC(=C2)Br)O)[N+](=O)[O-])F |
Product Overview
4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol (CAS 868256-48-8), with molecular formula C13H10BrFN2O3 and molecular weight 339.99 g/mol. IUPAC: 4-bromo-2-[(4-fluoro-3-nitroanilino)methyl]phenol.
Chemical Property Profile of 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol
Property Insights of 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol
The XLogP value of 3.8141 indicates that 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol. Following Lipinski's Rule of Five, 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol has 2 hydrogen bond donor(s) and 4 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 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol?
The CAS number of 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol is 868256-48-8.
What is the molecular formula of 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol?
The molecular formula of 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol is C13H10BrFN2O3.
What is the molecular weight of 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol?
The molecular weight of 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol is 339.99 g/mol.
Where can I buy 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol?
You can request a quote for 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-2-[(4-fluoro-3-nitroanilino)methyl]benzenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.