![N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline structure](/static/products/101/101091-87-6.png)
N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline
TL;DR: N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline (CAS 101091-87-6) is a chemical compound with molecular formula C15H15N3O4 and molecular weight 301.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline
Also Known As: N-(2,4-dinitro-phenethyl)-p-toluidine, N-<2-(2,4-Dinitro-phenyl-aethyl>-p-toluidin, N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline
| Molecular Formula | C15H15N3O4 |
|---|---|
| Molecular Weight | 301.11 g/mol |
| LogP | 3.46602 |
| Topological Polar Surface Area | 98.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 301.10626 |
| Heavy Atoms | 22 |
| Complexity | 698.4338 |
Chemical Identifiers
| CAS Number | 101091-87-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NCCC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-] |
Product Overview
N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline (CAS 101091-87-6), with molecular formula C15H15N3O4 and molecular weight 301.11 g/mol. IUPAC: N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline.
Chemical Property Profile of N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline
Property Insights of N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline
The XLogP value of 3.46602 indicates that N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.31 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline. Following Lipinski's Rule of Five, N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline has 1 hydrogen bond donor(s) and 5 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 N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline?
The CAS number of N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline is 101091-87-6.
What is the molecular formula of N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline?
The molecular formula of N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline is C15H15N3O4.
What is the molecular weight of N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline?
The molecular weight of N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline is 301.11 g/mol.
Where can I buy N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline?
You can request a quote for N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(2,4-dinitrophenyl)ethyl]-4-methylaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.