3-(2,5-Dimethylphenoxy)-5-nitroaniline
TL;DR: 3-(2,5-Dimethylphenoxy)-5-nitroaniline (CAS 832739-48-7) is a chemical compound with molecular formula C14H14N2O3 and molecular weight 258.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2,5-dimethylphenoxy)-5-nitroaniline
Also Known As: 3-(2,5-dimethylphenoxy)-5-nitroaniline, 3-(2,5-Dimethyl-phenoxy)-5-nitro-phenylamine, 5-(2,5-dimethylphenoxy)-3-nitrophenylamine, 3-(2,5-dimethylphenoxy)-5-nitro-aniline
| Molecular Formula | C14H14N2O3 |
|---|---|
| Molecular Weight | 258.10 g/mol |
| LogP | 3.58614 |
| Topological Polar Surface Area | 78.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 258.10043 |
| Heavy Atoms | 19 |
| Complexity | 638.5834 |
Chemical Identifiers
| CAS Number | 832739-48-7 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)C)OC2=CC(=CC(=C2)[N+](=O)[O-])N |
Product Overview
3-(2,5-Dimethylphenoxy)-5-nitroaniline (CAS 832739-48-7), with molecular formula C14H14N2O3 and molecular weight 258.10 g/mol. IUPAC: 3-(2,5-dimethylphenoxy)-5-nitroaniline.
Chemical Property Profile of 3-(2,5-Dimethylphenoxy)-5-nitroaniline
Property Insights of 3-(2,5-Dimethylphenoxy)-5-nitroaniline
The XLogP value of 3.58614 indicates that 3-(2,5-Dimethylphenoxy)-5-nitroaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.39 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(2,5-Dimethylphenoxy)-5-nitroaniline. Following Lipinski's Rule of Five, 3-(2,5-Dimethylphenoxy)-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-(2,5-Dimethylphenoxy)-5-nitroaniline?
The CAS number of 3-(2,5-Dimethylphenoxy)-5-nitroaniline is 832739-48-7.
What is the molecular formula of 3-(2,5-Dimethylphenoxy)-5-nitroaniline?
The molecular formula of 3-(2,5-Dimethylphenoxy)-5-nitroaniline is C14H14N2O3.
What is the molecular weight of 3-(2,5-Dimethylphenoxy)-5-nitroaniline?
The molecular weight of 3-(2,5-Dimethylphenoxy)-5-nitroaniline is 258.10 g/mol.
Where can I buy 3-(2,5-Dimethylphenoxy)-5-nitroaniline?
You can request a quote for 3-(2,5-Dimethylphenoxy)-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-(2,5-Dimethylphenoxy)-5-nitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 3-(2,5-Dimethylphenoxy)-5-nitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.