N-Ethyl-4-chlorobenzylamine
TL;DR: N-Ethyl-4-chlorobenzylamine (CAS 7297-86-1) is a chemical compound with molecular formula C9H12ClN and molecular weight 169.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(4-chlorophenyl)methyl]ethanamine
Also Known As: N-ETHYL-4-CHLOROBENZYLAMINE, N-(4-Chlorobenzyl)ethanamine, p-Chloro-N-ethylbenzylamine, N-[(4-chlorophenyl)methyl]ethanamine, (4-chlorobenzyl)ethylamine
| Molecular Formula | C9H12ClN |
|---|---|
| Molecular Weight | 169.07 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 12.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 169.06583 |
| Heavy Atoms | 11 |
| Complexity | 97.0 |
Chemical Identifiers
| CAS Number | 7297-86-1 |
|---|---|
| SMILES | CCNCC1=CC=C(C=C1)Cl |
| InChIKey | DWQGKMSNZGJKJS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Ethyl-4-chlorobenzylamine (CAS 7297-86-1), with molecular formula C9H12ClN and molecular weight 169.07 g/mol. IUPAC: N-[(4-chlorophenyl)methyl]ethanamine.
Chemical Property Profile of N-Ethyl-4-chlorobenzylamine
Property Insights of N-Ethyl-4-chlorobenzylamine
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Ethyl-4-chlorobenzylamine. With a topological polar surface area (TPSA) of 12.0 Ų, N-Ethyl-4-chlorobenzylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Ethyl-4-chlorobenzylamine has 1 hydrogen bond donor(s) and 1 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-Ethyl-4-chlorobenzylamine?
The CAS number of N-Ethyl-4-chlorobenzylamine is 7297-86-1.
What is the molecular formula of N-Ethyl-4-chlorobenzylamine?
The molecular formula of N-Ethyl-4-chlorobenzylamine is C9H12ClN.
What is the molecular weight of N-Ethyl-4-chlorobenzylamine?
The molecular weight of N-Ethyl-4-chlorobenzylamine is 169.07 g/mol.
Where can I buy N-Ethyl-4-chlorobenzylamine?
You can request a quote for N-Ethyl-4-chlorobenzylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Ethyl-4-chlorobenzylamine?
Yes, KEHONG BIO provides custom synthesis services for N-Ethyl-4-chlorobenzylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.