4-Methoxy-2,3-dinitroaniline
TL;DR: 4-Methoxy-2,3-dinitroaniline (CAS 6333-43-3) is a chemical compound with molecular formula C7H7N3O5 and molecular weight 213.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methoxy-2,3-dinitroaniline
Also Known As: 4-methoxy-2,3-dinitroaniline, 2,3-dinitro-4-methoxyaniline, 4-methoxy-2,3-dinitrophenylamine, 1-(pyridin-2-ylmethyl)-2,3-dihydroindole, AO-801/41077415
| Molecular Formula | C7H7N3O5 |
|---|---|
| Molecular Weight | 213.04 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 127.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 1 |
| Exact Mass | 213.03857 |
| Heavy Atoms | 15 |
| Complexity | 260.0 |
Chemical Identifiers
| CAS Number | 6333-43-3 |
|---|---|
| SMILES | COC1=C(C(=C(C=C1)N)[N+](=O)[O-])[N+](=O)[O-] |
| InChIKey | KKIFNGUMEDQAHY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Methoxy-2,3-dinitroaniline (CAS 6333-43-3), with molecular formula C7H7N3O5 and molecular weight 213.04 g/mol. IUPAC: 4-methoxy-2,3-dinitroaniline.
Chemical Property Profile of 4-Methoxy-2,3-dinitroaniline
Property Insights of 4-Methoxy-2,3-dinitroaniline
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Methoxy-2,3-dinitroaniline. The TPSA of 127.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Methoxy-2,3-dinitroaniline. Following Lipinski's Rule of Five, 4-Methoxy-2,3-dinitroaniline has 1 hydrogen bond donor(s) and 6 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-Methoxy-2,3-dinitroaniline?
The CAS number of 4-Methoxy-2,3-dinitroaniline is 6333-43-3.
What is the molecular formula of 4-Methoxy-2,3-dinitroaniline?
The molecular formula of 4-Methoxy-2,3-dinitroaniline is C7H7N3O5.
What is the molecular weight of 4-Methoxy-2,3-dinitroaniline?
The molecular weight of 4-Methoxy-2,3-dinitroaniline is 213.04 g/mol.
Where can I buy 4-Methoxy-2,3-dinitroaniline?
You can request a quote for 4-Methoxy-2,3-dinitroaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Methoxy-2,3-dinitroaniline?
Yes, KEHONG BIO provides custom synthesis services for 4-Methoxy-2,3-dinitroaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.