Pinacol dimethyl ether
TL;DR: Pinacol dimethyl ether (CAS 6091-59-4) is a chemical compound with molecular formula C8H18O2 and molecular weight 146.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dimethoxy-2,3-dimethylbutane
Also Known As: 2,3-Dimethoxy-2,3-dimethylbutane, Pinacol dimethyl ether, Pinacol dimethyl ether [MI], Butane, 2,3-dimethoxy-2,3-dimethyl-, 2,3-dimethyl-2,3-dimethoxybutane
| Molecular Formula | C8H18O2 |
|---|---|
| Molecular Weight | 146.13 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 18.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 146.13068 |
| Heavy Atoms | 10 |
| Complexity | 91.0 |
Chemical Identifiers
| CAS Number | 6091-59-4 |
|---|---|
| SMILES | CC(C)(C(C)(C)OC)OC |
| InChIKey | MRSDBHMEFNIHKP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Pinacol dimethyl ether (CAS 6091-59-4), with molecular formula C8H18O2 and molecular weight 146.13 g/mol. IUPAC: 2,3-dimethoxy-2,3-dimethylbutane.
Chemical Property Profile of Pinacol dimethyl ether
Property Insights of Pinacol dimethyl ether
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pinacol dimethyl ether. With a topological polar surface area (TPSA) of 18.5 Ų, Pinacol dimethyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pinacol dimethyl ether has 0 hydrogen bond donor(s) and 2 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 Pinacol dimethyl ether?
The CAS number of Pinacol dimethyl ether is 6091-59-4.
What is the molecular formula of Pinacol dimethyl ether?
The molecular formula of Pinacol dimethyl ether is C8H18O2.
What is the molecular weight of Pinacol dimethyl ether?
The molecular weight of Pinacol dimethyl ether is 146.13 g/mol.
Where can I buy Pinacol dimethyl ether?
You can request a quote for Pinacol dimethyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Pinacol dimethyl ether?
Yes, KEHONG BIO provides custom synthesis services for Pinacol dimethyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.