4-(2-Chloroethoxy)aniline
TL;DR: 4-(2-Chloroethoxy)aniline (CAS 27692-35-9) is a chemical compound with molecular formula C8H10ClNO and molecular weight 171.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-chloroethoxy)aniline
Also Known As: 4-(2-chloroethoxy)aniline, 4-(Chloroethoxy)aniline, 4-(2-chloroethoxy)-aniline, Benzenamine, 4-(2-chloroethoxy)-, 4-(2'-chloroethoxy)-aniline
| Molecular Formula | C8H10ClNO |
|---|---|
| Molecular Weight | 171.05 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 35.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 171.04509 |
| Heavy Atoms | 11 |
| Complexity | 102.0 |
Chemical Identifiers
| CAS Number | 27692-35-9 |
|---|---|
| SMILES | C1=CC(=CC=C1N)OCCCl |
| InChIKey | JQRJWBDPSJFJPY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-(2-Chloroethoxy)aniline (CAS 27692-35-9), with molecular formula C8H10ClNO and molecular weight 171.05 g/mol. IUPAC: 4-(2-chloroethoxy)aniline.
Chemical Property Profile of 4-(2-Chloroethoxy)aniline
Property Insights of 4-(2-Chloroethoxy)aniline
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Chloroethoxy)aniline. With a topological polar surface area (TPSA) of 35.3 Ų, 4-(2-Chloroethoxy)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-Chloroethoxy)aniline 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
Frequently Asked Questions
What is the CAS number of 4-(2-Chloroethoxy)aniline?
The CAS number of 4-(2-Chloroethoxy)aniline is 27692-35-9.
What is the molecular formula of 4-(2-Chloroethoxy)aniline?
The molecular formula of 4-(2-Chloroethoxy)aniline is C8H10ClNO.
What is the molecular weight of 4-(2-Chloroethoxy)aniline?
The molecular weight of 4-(2-Chloroethoxy)aniline is 171.05 g/mol.
Where can I buy 4-(2-Chloroethoxy)aniline?
You can request a quote for 4-(2-Chloroethoxy)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-Chloroethoxy)aniline?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-Chloroethoxy)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.