Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)-
TL;DR: Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)- (CAS 24276-91-3) is a chemical compound with molecular formula C13H9F3N2O3 and molecular weight 298.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-nitrophenoxy)-5-(trifluoromethyl)aniline
Also Known As: 2- -5- benzeneamine, 4-Amino-3,5-dichlorobenzotrifluoride, 2-(4-nitrophenoxy)-5-(trifluoromethyl)aniline, Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)-, 2-(4-Nitrophenoxy)-5-(trifluoromethyl)benzeneamine
| Molecular Formula | C13H9F3N2O3 |
|---|---|
| Molecular Weight | 298.06 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 81.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 298.05652 |
| Heavy Atoms | 21 |
| Complexity | 365.0 |
Chemical Identifiers
| CAS Number | 24276-91-3 |
|---|---|
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])OC2=C(C=C(C=C2)C(F)(F)F)N |
| InChIKey | RAJUPQAENBFSSM-UHFFFAOYSA-N |
Product Overview
Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)- (CAS 24276-91-3), with molecular formula C13H9F3N2O3 and molecular weight 298.06 g/mol. IUPAC: 2-(4-nitrophenoxy)-5-(trifluoromethyl)aniline.
Chemical Property Profile of Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)-
Property Insights of Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)-
The XLogP value of 3.1 indicates that Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)-. Following Lipinski's Rule of Five, Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)- has 1 hydrogen bond donor(s) and 7 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 Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)-?
The CAS number of Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)- is 24276-91-3.
What is the molecular formula of Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)-?
The molecular formula of Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)- is C13H9F3N2O3.
What is the molecular weight of Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)-?
The molecular weight of Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)- is 298.06 g/mol.
Where can I buy Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)-?
You can request a quote for Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzeneamine, 2-(4-nitrophenoxy)-5-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.