Diethylene glycol monohexyl ether
TL;DR: Diethylene glycol monohexyl ether (CAS 112-59-4) is a chemical compound with molecular formula C10H22O3 and molecular weight 190.15689 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(2-hexoxyethoxy)ethanol
Also Known As: Diethylene glycol monohexyl ether, Hexyl carbitol, Hexol carbitol, n-Hexyl carbitol, 2-(2-Hexyloxyethoxy)ethanol
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H22O3 |
| Molecular Weight | 190.15689 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 38.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 190.15689 Da |
| Heavy Atoms | 13 |
| Complexity | 86.0 |
| Melting Point | -27.4 °F (USCG, 1999) |
| Boiling Point | 498.4 °F at 760 mmHg (USCG, 1999) |
| Density | 0.9346 at 68 °F (USCG, 1999) - Less dense than water; will float |
| Flash Point | 285 °F (USCG, 1999) |
| Vapor Pressure | 0.000503 [mmHg] |
| Solubility | In water, 17,000 mg/L at 20 °C |
| SMILES | CCCCCCOCCOCCO |
| InChIKey | GZMAAYIALGURDQ-UHFFFAOYSA-N |
Chemical Property Profile of Diethylene glycol monohexyl ether
Property Insights of Diethylene glycol monohexyl ether
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethylene glycol monohexyl ether. With a topological polar surface area (TPSA) of 38.7 Ų, Diethylene glycol monohexyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diethylene glycol monohexyl ether 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
What is the CAS number of Diethylene glycol monohexyl ether?
The CAS number of Diethylene glycol monohexyl ether is 112-59-4.
What is the molecular formula of Diethylene glycol monohexyl ether?
The molecular formula of Diethylene glycol monohexyl ether is C10H22O3.
What is the molecular weight of Diethylene glycol monohexyl ether?
The molecular weight of Diethylene glycol monohexyl ether is 190.15689 g/mol.
Where can I buy Diethylene glycol monohexyl ether?
You can request a quote for Diethylene glycol monohexyl ether directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diethylene glycol monohexyl ether?
Yes, CoreyChem provides custom synthesis services for Diethylene glycol monohexyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.