Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)-
TL;DR: Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)- (CAS 52788-78-0) is a chemical compound with molecular formula C12H26O3 and molecular weight 218.1882 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[2-[2-[(2-methylpropan-2-yl)oxy]ethoxy]ethoxy]butane
Also Known As: 1-[2-(2-tert-butoxyethoxy)ethoxy]butane, KST-1B5031, 1-[2-[2-(TERT-BUTOXY)ETHOXY]ETHOXY]BUTANE, Butane, 1-[2-[2-(1,1-dimethylethoxy)ethoxy]ethoxy]-, Diethylene glycol butyl tert-butyl ether
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C12H26O3 |
| Molecular Weight | 218.1882 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 27.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 218.1882 Da |
| Heavy Atoms | 15 |
| Complexity | 129.0 |
| SMILES | CCCCOCCOCCOC(C)(C)C |
| InChIKey | WQQZDUVVRLTLIJ-UHFFFAOYSA-N |
Chemical Property Profile of Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)-
Property Insights of Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)-
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)-. With a topological polar surface area (TPSA) of 27.7 Ų, Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)- 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
What is the CAS number of Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)-?
The CAS number of Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)- is 52788-78-0.
What is the molecular formula of Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)-?
The molecular formula of Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)- is C12H26O3.
What is the molecular weight of Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)-?
The molecular weight of Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)- is 218.1882 g/mol.
Where can I buy Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)-?
You can request a quote for Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)-?
Yes, CoreyChem provides custom synthesis services for Butane, 1-(2-(2-(1,1-dimethylethoxy)ethoxy)ethoxy)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.