Diisopropyl Ether
TL;DR: Diisopropyl Ether (CAS 108-20-3) is a chemical compound with molecular formula C6H14O and molecular weight 102.10446 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-propan-2-yloxypropane
Also Known As: Diisopropyl ether, ISOPROPYL ETHER, 2-Isopropoxypropane, diisopropylether, Diisopropyl oxide
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H14O |
| Molecular Weight | 102.10446 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 9.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 102.10446 Da |
| Heavy Atoms | 7 |
| Complexity | 33.0 |
| Melting Point | -123 °F (USCG, 1999) |
| Boiling Point | 156 °F at 760 mmHg (USCG, 1999) |
| Density | 0.724 at 68 °F (USCG, 1999) - Less dense than water; will float |
| Flash Point | -18 °F (USCG, 1999) |
| Vapor Pressure | 119 mmHg (NIOSH, 2024) |
| Refractive Index | Index of refraction: 1.3679 @ 20 °C/D |
| Solubility | 0.2 % (NIOSH, 2024) |
| SMILES | CC(C)OC(C)C |
| InChIKey | ZAFNJMIOTHYJRJ-UHFFFAOYSA-N |
Product Description
Applications: Diisopropyl Ether is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Diisopropyl Ether is a heterocyclic building block identified by CAS number 108-20-3 and the molecular formula C6H14O and a molecular weight of 102.1 g/mol. Physically, the compound has a density of 0.724 at 68 °F (USCG, 1999) - Less dense than water; will float g/cm³, a solubility: 0.2 % (NIOSH, 2024). Synonyms include Diisopropyl ether and ISOPROPYL ETHER.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of Diisopropyl Ether
Property Insights of Diisopropyl Ether
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diisopropyl Ether. With a topological polar surface area (TPSA) of 9.2 Ų, Diisopropyl Ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Diisopropyl Ether 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
What is the CAS number of Diisopropyl Ether?
The CAS number of Diisopropyl Ether is 108-20-3.
What is the molecular formula of Diisopropyl Ether?
The molecular formula of Diisopropyl Ether is C6H14O.
What is the molecular weight of Diisopropyl Ether?
The molecular weight of Diisopropyl Ether is 102.10446 g/mol.
What are the applications of Diisopropyl Ether?
Diisopropyl Ether is used in heterocycle construction in medicinal chemistry and agrochemical discovery, as well as pharmaceutical synthesis routes and API production. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and...
Where can I buy Diisopropyl Ether?
You can request a quote for Diisopropyl Ether directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Diisopropyl Ether?
Yes, CoreyChem provides custom synthesis services for Diisopropyl Ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.