1-Chloro-3,6,9-trioxadecane
TL;DR: 1-Chloro-3,6,9-trioxadecane (CAS 52995-76-3) is a chemical compound with molecular formula C7H15ClO3 and molecular weight 182.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(2-chloroethoxy)ethoxy]-2-methoxyethane
Also Known As: 1-chloro-2-(2-(2-methoxyethoxy)ethoxy)ethane, 1-chloro-3,6,9-trioxadecane, 1-(2-CHLORO-ETHOXY)-2-(2-METHOXY-ETHOXY)-ETHANE, 3,6,9-trioxadecyl chloride, 1-Chloro-2-[2-(2-methoxyethoxy)ethoxy]ethane
| Molecular Formula | C7H15ClO3 |
|---|---|
| Molecular Weight | 182.07 g/mol |
| LogP | 0.2 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Exact Mass | 182.07097 |
| Heavy Atoms | 11 |
| Complexity | 70.0 |
Chemical Identifiers
| CAS Number | 52995-76-3 |
|---|---|
| SMILES | COCCOCCOCCCl |
| InChIKey | WODLURYTHKQUET-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 14 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Chloro-3,6,9-trioxadecane (CAS 52995-76-3), with molecular formula C7H15ClO3 and molecular weight 182.07 g/mol. IUPAC: 1-[2-(2-chloroethoxy)ethoxy]-2-methoxyethane.
Chemical Property Profile of 1-Chloro-3,6,9-trioxadecane
Property Insights of 1-Chloro-3,6,9-trioxadecane
The XLogP value of 0.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Chloro-3,6,9-trioxadecane. With a topological polar surface area (TPSA) of 27.7 Ų, 1-Chloro-3,6,9-trioxadecane exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Chloro-3,6,9-trioxadecane has 0 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 1-Chloro-3,6,9-trioxadecane?
The CAS number of 1-Chloro-3,6,9-trioxadecane is 52995-76-3.
What is the molecular formula of 1-Chloro-3,6,9-trioxadecane?
The molecular formula of 1-Chloro-3,6,9-trioxadecane is C7H15ClO3.
What is the molecular weight of 1-Chloro-3,6,9-trioxadecane?
The molecular weight of 1-Chloro-3,6,9-trioxadecane is 182.07 g/mol.
Where can I buy 1-Chloro-3,6,9-trioxadecane?
You can request a quote for 1-Chloro-3,6,9-trioxadecane directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Chloro-3,6,9-trioxadecane?
Yes, KEHONG BIO provides custom synthesis services for 1-Chloro-3,6,9-trioxadecane and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.