2,2'-二氯乙醚
TL;DR: 2,2'-二氯乙醚 (CAS 111-44-4) is a chemical compound with molecular formula C4H8Cl2O and molecular weight 142.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2'-二氯乙醚
1-chloro-2-(2-chloroethoxy)ethane
Also Known As: 2-Chloroethyl ether, 2,2'-Dichlorodiethyl ether, Chlorex, BIS(2-CHLOROETHYL) ETHER, Dichloroether
| Molecular Formula | C4H8Cl2O |
|---|---|
| Molecular Weight | 142.00 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 141.99522 |
| Heavy Atoms | 7 |
| Complexity | 28.0 |
| Melting Point | -50.0 °C |
| Boiling Point | 177.8 °C at 760 mmHg |
| Density | 1.22 at 20.0 °C |
| Solubility | Reaction (NTP, 1992) |
| Flash Point | 55.0 °C |
| Vapor Pressure | 0.7 mmHg at 20.0 °C |
| Refractive Index | 1.451 @ 20 °C |
Chemical Identifiers
| CAS Number | 111-44-4 |
|---|---|
| SMILES | C(CCl)OCCCl |
| InChIKey | ZNSMNVMLTJELDZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2'-二氯乙醚 (CAS 111-44-4), with molecular formula C4H8Cl2O and molecular weight 142.00 g/mol. IUPAC: 1-chloro-2-(2-chloroethoxy)ethane.
Chemical Property Profile of 2,2'-二氯乙醚
Property Insights of 2,2'-二氯乙醚
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2'-二氯乙醚. With a topological polar surface area (TPSA) of 9.2 Ų, 2,2'-二氯乙醚 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2'-二氯乙醚 has 0 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 2,2'-二氯乙醚?
The CAS number of 2,2'-二氯乙醚 is 111-44-4.
What is the molecular formula of 2,2'-二氯乙醚?
The molecular formula of 2,2'-二氯乙醚 is C4H8Cl2O.
What is the molecular weight of 2,2'-二氯乙醚?
The molecular weight of 2,2'-二氯乙醚 is 142.00 g/mol.
Where can I buy 2,2'-二氯乙醚?
You can request a quote for 2,2'-二氯乙醚 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-二氯乙醚?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-二氯乙醚 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.