2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline
TL;DR: 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline (CAS 722470-02-2) is a chemical compound with molecular formula C16H18ClNO2 and molecular weight 291.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-[(3-ethoxy-4-methoxyphenyl)methyl]aniline
Also Known As: 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline, 2-chloro-N-[(3-ethoxy-4-methoxyphenyl)methyl]aniline, AH-487/42191624, N-(2-chlorophenyl)-N-(3-ethoxy-4-methoxybenzyl)amine
| Molecular Formula | C16H18ClNO2 |
|---|---|
| Molecular Weight | 291.10 g/mol |
| LogP | 4.3594 |
| Topological Polar Surface Area | 30.49 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 291.1026 |
| Heavy Atoms | 20 |
| Complexity | 572.1534 |
Chemical Identifiers
| CAS Number | 722470-02-2 |
|---|---|
| SMILES | CCOC1=C(C=CC(=C1)CNC2=CC=CC=C2Cl)OC |
Product Overview
2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline (CAS 722470-02-2), with molecular formula C16H18ClNO2 and molecular weight 291.10 g/mol. IUPAC: 2-chloro-N-[(3-ethoxy-4-methoxyphenyl)methyl]aniline.
Chemical Property Profile of 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline
Property Insights of 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline
The XLogP value of 4.3594 indicates that 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 30.49 Ų, 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline has 1 hydrogen bond donor(s) and 3 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-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline?
The CAS number of 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline is 722470-02-2.
What is the molecular formula of 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline?
The molecular formula of 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline is C16H18ClNO2.
What is the molecular weight of 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline?
The molecular weight of 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline is 291.10 g/mol.
Where can I buy 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline?
You can request a quote for 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 2-chloro-N-(3-ethoxy-4-methoxybenzyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.