3-(2,2-Difluoroethoxy)-5-nitroaniline
TL;DR: 3-(2,2-Difluoroethoxy)-5-nitroaniline (CAS 832738-29-1) is a chemical compound with molecular formula C8H8F2N2O3 and molecular weight 218.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,2-difluoroethoxy)-5-nitroaniline
Also Known As: 3-(2,2-difluoroethoxy)-5-nitroaniline, 3-(2,2-difluoroethoxy)-5-nitro-aniline, 3-(2,2-Difluoro-ethoxy)-5-nitro-phenylamine, 3-(2,2-Difluoroethoxy)-5-nitrobenzenamine, 5-(2,2-difluoroethoxy)-3-nitrophenylamine
| Molecular Formula | C8H8F2N2O3 |
|---|---|
| Molecular Weight | 218.05 g/mol |
| LogP | 1.8209 |
| Topological Polar Surface Area | 78.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 218.0503 |
| Heavy Atoms | 15 |
| Complexity | 370.90445 |
Chemical Identifiers
| CAS Number | 832738-29-1 |
|---|---|
| SMILES | C1=C(C=C(C=C1[N+](=O)[O-])OCC(F)F)N |
Product Overview
3-(2,2-Difluoroethoxy)-5-nitroaniline (CAS 832738-29-1), with molecular formula C8H8F2N2O3 and molecular weight 218.05 g/mol. IUPAC: 3-(2,2-difluoroethoxy)-5-nitroaniline.
Chemical Property Profile of 3-(2,2-Difluoroethoxy)-5-nitroaniline
Property Insights of 3-(2,2-Difluoroethoxy)-5-nitroaniline
The XLogP value of 1.8209 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(2,2-Difluoroethoxy)-5-nitroaniline. The TPSA of 78.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,2-Difluoroethoxy)-5-nitroaniline. Following Lipinski's Rule of Five, 3-(2,2-Difluoroethoxy)-5-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 3-(2,2-Difluoroethoxy)-5-nitroaniline?
The CAS number of 3-(2,2-Difluoroethoxy)-5-nitroaniline is 832738-29-1.
What is the molecular formula of 3-(2,2-Difluoroethoxy)-5-nitroaniline?
The molecular formula of 3-(2,2-Difluoroethoxy)-5-nitroaniline is C8H8F2N2O3.
What is the molecular weight of 3-(2,2-Difluoroethoxy)-5-nitroaniline?
The molecular weight of 3-(2,2-Difluoroethoxy)-5-nitroaniline is 218.05 g/mol.
Where can I buy 3-(2,2-Difluoroethoxy)-5-nitroaniline?
You can request a quote for 3-(2,2-Difluoroethoxy)-5-nitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(2,2-Difluoroethoxy)-5-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,2-Difluoroethoxy)-5-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.