Diethylene glycol dibutyl ether
TL;DR: Diethylene glycol dibutyl ether (CAS 112-73-2) is a chemical compound with molecular formula C12H26O3 and molecular weight 218.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[2-(2-butoxyethoxy)ethoxy]butane
Also Known As: DIETHYLENE GLYCOL DIBUTYL ETHER, Dibutyl carbitol, Bis(2-butoxyethyl) ether, Butyl diglyme, 1-(2-(2-Butoxyethoxy)ethoxy)butane
| Molecular Formula | C12H26O3 |
|---|---|
| Molecular Weight | 218.19 g/mol |
| LogP | 1.9 |
| Topological Polar Surface Area | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 12 |
| Exact Mass | 218.1882 |
| Heavy Atoms | 15 |
| Complexity | 95.0 |
| Melting Point | -60.0 °C |
| Boiling Point | 256.1 °C at 760 mmHg |
| Density | 0.885 - Less dense than water; will float |
| Solubility | less than 1 mg/mL at 72 °F (NTP, 1992) |
| Flash Point | 118.3 °C |
| Vapor Pressure | 0.02 mmHg at 20.0 °C |
Chemical Identifiers
| CAS Number | 112-73-2 |
|---|---|
| SMILES | CCCCOCCOCCOCCCC |
| InChIKey | KZVBBTZJMSWGTK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 22 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethylene glycol dibutyl ether (CAS 112-73-2), with molecular formula C12H26O3 and molecular weight 218.19 g/mol. IUPAC: 1-[2-(2-butoxyethoxy)ethoxy]butane.
Chemical Property Profile of Diethylene glycol dibutyl ether
Property Insights of Diethylene glycol dibutyl ether
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethylene glycol dibutyl ether. With a topological polar surface area (TPSA) of 27.7 Ų, Diethylene glycol dibutyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethylene glycol dibutyl ether 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 Diethylene glycol dibutyl ether?
The CAS number of Diethylene glycol dibutyl ether is 112-73-2.
What is the molecular formula of Diethylene glycol dibutyl ether?
The molecular formula of Diethylene glycol dibutyl ether is C12H26O3.
What is the molecular weight of Diethylene glycol dibutyl ether?
The molecular weight of Diethylene glycol dibutyl ether is 218.19 g/mol.
Where can I buy Diethylene glycol dibutyl ether?
You can request a quote for Diethylene glycol dibutyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethylene glycol dibutyl ether?
Yes, KEHONG BIO provides custom synthesis services for Diethylene glycol dibutyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.