2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline
TL;DR: 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline (CAS 356091-34-4) is a chemical compound with molecular formula C15H16N2O3 and molecular weight 272.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methoxy-5-methyl-N-[(2-nitrophenyl)methyl]aniline
Also Known As: 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline, BAS 01124661, 2-methoxy-5-methyl-N-[(2-nitrophenyl)methyl]aniline, AB00087871-01, (2-Methoxy-5-methyl-phenyl)-(2-nitro-benzyl)-amine
| Molecular Formula | C15H16N2O3 |
|---|---|
| Molecular Weight | 272.12 g/mol |
| LogP | 3.6 |
| Topological Polar Surface Area | 67.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 272.1161 |
| Heavy Atoms | 20 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 356091-34-4 |
|---|---|
| SMILES | CC1=CC(=C(C=C1)OC)NCC2=CC=CC=C2[N+](=O)[O-] |
| InChIKey | SYSPQFQVPGHGTA-UHFFFAOYSA-N |
Product Overview
2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline (CAS 356091-34-4), with molecular formula C15H16N2O3 and molecular weight 272.12 g/mol. IUPAC: 2-methoxy-5-methyl-N-[(2-nitrophenyl)methyl]aniline.
Chemical Property Profile of 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline
Property Insights of 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline
The XLogP value of 3.6 indicates that 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline. Following Lipinski's Rule of Five, 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline 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 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline?
The CAS number of 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline is 356091-34-4.
What is the molecular formula of 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline?
The molecular formula of 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline is C15H16N2O3.
What is the molecular weight of 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline?
The molecular weight of 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline is 272.12 g/mol.
Where can I buy 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline?
You can request a quote for 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-methoxy-5-methyl-N-(2-nitrobenzyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.