3,4-Bis(2-chloroethoxy)aniline
TL;DR: 3,4-Bis(2-chloroethoxy)aniline (CAS 165598-58-3) is a chemical compound with molecular formula C10H13Cl2NO2 and molecular weight 249.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4-bis(2-chloroethoxy)aniline
Also Known As: 3,4-bis(2-chloroethoxy)aniline, 3,4-bis(2-chloroethoxy)benzenamine, 3,4-bis(2-chloroethoxy)phenylamine, 3,4-Bis-(2-chloro-ethoxy)-phenylamine, Benzenamine, 3,4-bis(2-chloroethoxy)-
| Molecular Formula | C10H13Cl2NO2 |
|---|---|
| Molecular Weight | 249.03 g/mol |
| LogP | 2.504 |
| Topological Polar Surface Area | 44.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 249.03233 |
| Heavy Atoms | 15 |
| Complexity | 307.4739 |
Chemical Identifiers
| CAS Number | 165598-58-3 |
|---|---|
| SMILES | C1=CC(=C(C=C1N)OCCCl)OCCCl |
Product Overview
3,4-Bis(2-chloroethoxy)aniline (CAS 165598-58-3), with molecular formula C10H13Cl2NO2 and molecular weight 249.03 g/mol. IUPAC: 3,4-bis(2-chloroethoxy)aniline.
Chemical Property Profile of 3,4-Bis(2-chloroethoxy)aniline
Property Insights of 3,4-Bis(2-chloroethoxy)aniline
The XLogP value of 2.504 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4-Bis(2-chloroethoxy)aniline. With a topological polar surface area (TPSA) of 44.48 Ų, 3,4-Bis(2-chloroethoxy)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3,4-Bis(2-chloroethoxy)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 3,4-Bis(2-chloroethoxy)aniline?
The CAS number of 3,4-Bis(2-chloroethoxy)aniline is 165598-58-3.
What is the molecular formula of 3,4-Bis(2-chloroethoxy)aniline?
The molecular formula of 3,4-Bis(2-chloroethoxy)aniline is C10H13Cl2NO2.
What is the molecular weight of 3,4-Bis(2-chloroethoxy)aniline?
The molecular weight of 3,4-Bis(2-chloroethoxy)aniline is 249.03 g/mol.
Where can I buy 3,4-Bis(2-chloroethoxy)aniline?
You can request a quote for 3,4-Bis(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 3,4-Bis(2-chloroethoxy)aniline?
Yes, KEHONG BIO provides custom synthesis services for 3,4-Bis(2-chloroethoxy)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.