N-(3-Chlorobenzyl)-4-ethoxyaniline
TL;DR: N-(3-Chlorobenzyl)-4-ethoxyaniline (CAS 1019567-03-3) is a chemical compound with molecular formula C15H16ClNO and molecular weight 261.09204 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(3-chlorophenyl)methyl]-4-ethoxyaniline
Also Known As: N-(3-CHLOROBENZYL)-4-ETHOXYANILINE, N-[(3-chlorophenyl)methyl]-4-ethoxyaniline, N-[(3-chlorophenyl)methyl]-4-ethoxy-aniline, Benzenemethanamine, 3-chloro-N-(4-ethoxyphenyl)-
Technical Specifications
| Molecular Formula | C15H16ClNO |
| Molecular Weight | 261.09204 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 21.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 261.09204 Da |
| Heavy Atoms | 18 |
| Complexity | 229.0 |
| SMILES | CCOC1=CC=C(C=C1)NCC2=CC(=CC=C2)Cl |
| InChIKey | SZFMMQOMFLBOMX-UHFFFAOYSA-N |
Chemical Property Profile of N-(3-Chlorobenzyl)-4-ethoxyaniline
Property Insights of N-(3-Chlorobenzyl)-4-ethoxyaniline
The XLogP value of 4.4 indicates that N-(3-Chlorobenzyl)-4-ethoxyaniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.3 Ų, N-(3-Chlorobenzyl)-4-ethoxyaniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(3-Chlorobenzyl)-4-ethoxyaniline has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-(3-Chlorobenzyl)-4-ethoxyaniline?
The CAS number of N-(3-Chlorobenzyl)-4-ethoxyaniline is 1019567-03-3.
What is the molecular formula of N-(3-Chlorobenzyl)-4-ethoxyaniline?
The molecular formula of N-(3-Chlorobenzyl)-4-ethoxyaniline is C15H16ClNO.
What is the molecular weight of N-(3-Chlorobenzyl)-4-ethoxyaniline?
The molecular weight of N-(3-Chlorobenzyl)-4-ethoxyaniline is 261.09204 g/mol.
Where can I buy N-(3-Chlorobenzyl)-4-ethoxyaniline?
You can request a quote for N-(3-Chlorobenzyl)-4-ethoxyaniline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3-Chlorobenzyl)-4-ethoxyaniline?
Yes, CoreyChem provides custom synthesis services for N-(3-Chlorobenzyl)-4-ethoxyaniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.