Pinacol
TL;DR: Pinacol (CAS 76-09-5) is a chemical compound with molecular formula C6H14O2 and molecular weight 118.09938 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3-dimethylbutane-2,3-diol
Also Known As: PINACOL, 2,3-Dimethylbutane-2,3-diol, Pinacone, Tetramethylethylene glycol, 2,3-Dimethyl-2,3-butanediol
Application Areas
Top 5 of 22 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C6H14O2 |
| Molecular Weight | 118.09938 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 40.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 118.09938 Da |
| Heavy Atoms | 8 |
| Complexity | 72.0 |
| Vapor Pressure | 0.5 [mmHg] |
| SMILES | CC(C)(C(C)(C)O)O |
| InChIKey | IVDFJHOHABJVEH-UHFFFAOYSA-N |
Product Description
Applications: Pinacol is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. 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).
A pharmaceutical intermediate supplied by CoreyChem, Pinacol (CAS 76-09-5) has the molecular formula C6H14O2 and a molecular weight of 118.1 g/mol. Synonyms include PINACOL and 2,3-Dimethylbutane-2,3-diol.
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 Pinacol
Property Insights of Pinacol
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pinacol. With a topological polar surface area (TPSA) of 40.5 Ų, Pinacol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pinacol has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Pinacol?
The CAS number of Pinacol is 76-09-5.
What is the molecular formula of Pinacol?
The molecular formula of Pinacol is C6H14O2.
What is the molecular weight of Pinacol?
The molecular weight of Pinacol is 118.09938 g/mol.
What are the applications of Pinacol?
Pinacol is used in pharmaceutical synthesis routes and API production, as well as heterocycle construction in medicinal chemistry and agrochemical discovery. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis...
Where can I buy Pinacol?
You can request a quote for Pinacol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pinacol?
Yes, CoreyChem provides custom synthesis services for Pinacol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.