4-Bromo-5-(difluoromethoxy)-2-nitroaniline
TL;DR: 4-Bromo-5-(difluoromethoxy)-2-nitroaniline (CAS 722464-77-9) is a chemical compound with molecular formula C7H5BrF2N2O3 and molecular weight 281.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-bromo-5-(difluoromethoxy)-2-nitroaniline
Also Known As: 4-bromo-5-(difluoromethoxy)-2-nitroaniline
| Molecular Formula | C7H5BrF2N2O3 |
|---|---|
| Molecular Weight | 281.95 g/mol |
| LogP | 2.5409 |
| Topological Polar Surface Area | 78.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.94516 |
| Heavy Atoms | 15 |
| Complexity | 400.06683 |
Chemical Identifiers
| CAS Number | 722464-77-9 |
|---|---|
| SMILES | C1=C(C(=CC(=C1OC(F)F)Br)[N+](=O)[O-])N |
Product Overview
4-Bromo-5-(difluoromethoxy)-2-nitroaniline (CAS 722464-77-9), with molecular formula C7H5BrF2N2O3 and molecular weight 281.95 g/mol. IUPAC: 4-bromo-5-(difluoromethoxy)-2-nitroaniline.
Chemical Property Profile of 4-Bromo-5-(difluoromethoxy)-2-nitroaniline
Property Insights of 4-Bromo-5-(difluoromethoxy)-2-nitroaniline
The XLogP value of 2.5409 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Bromo-5-(difluoromethoxy)-2-nitroaniline. The TPSA of 78.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Bromo-5-(difluoromethoxy)-2-nitroaniline. Following Lipinski's Rule of Five, 4-Bromo-5-(difluoromethoxy)-2-nitroaniline has 1 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-5-(difluoromethoxy)-2-nitroaniline?
The CAS number of 4-Bromo-5-(difluoromethoxy)-2-nitroaniline is 722464-77-9.
What is the molecular formula of 4-Bromo-5-(difluoromethoxy)-2-nitroaniline?
The molecular formula of 4-Bromo-5-(difluoromethoxy)-2-nitroaniline is C7H5BrF2N2O3.
What is the molecular weight of 4-Bromo-5-(difluoromethoxy)-2-nitroaniline?
The molecular weight of 4-Bromo-5-(difluoromethoxy)-2-nitroaniline is 281.95 g/mol.
Where can I buy 4-Bromo-5-(difluoromethoxy)-2-nitroaniline?
You can request a quote for 4-Bromo-5-(difluoromethoxy)-2-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Bromo-5-(difluoromethoxy)-2-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-Bromo-5-(difluoromethoxy)-2-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.