2,3,4-Trimethylpentan-2-ol
TL;DR: 2,3,4-Trimethylpentan-2-ol (CAS 66576-26-9) is a chemical compound with molecular formula C8H18O and molecular weight 130.13577 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3,4-trimethylpentan-2-ol
Also Known As: 2,3,4-trimethylpentan-2-ol, 2,3,4-Trimethyl-3-pentanol, 2-Pentanol,2,3,4-trimethyl-, 2-Pentanol, 2,3,4-trimethyl-, 2,3,4-TRIMETHYL-2-PENTANOL
Application Areas
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C8H18O |
| Molecular Weight | 130.13577 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 130.13577 Da |
| Heavy Atoms | 9 |
| Complexity | 84.0 |
| SMILES | CC(C)C(C)C(C)(C)O |
| InChIKey | FTPXXARYDFWPGE-UHFFFAOYSA-N |
Chemical Property Profile of 2,3,4-Trimethylpentan-2-ol
Property Insights of 2,3,4-Trimethylpentan-2-ol
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,3,4-Trimethylpentan-2-ol. With a topological polar surface area (TPSA) of 20.2 Ų, 2,3,4-Trimethylpentan-2-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,3,4-Trimethylpentan-2-ol has 1 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 2,3,4-Trimethylpentan-2-ol?
The CAS number of 2,3,4-Trimethylpentan-2-ol is 66576-26-9.
What is the molecular formula of 2,3,4-Trimethylpentan-2-ol?
The molecular formula of 2,3,4-Trimethylpentan-2-ol is C8H18O.
What is the molecular weight of 2,3,4-Trimethylpentan-2-ol?
The molecular weight of 2,3,4-Trimethylpentan-2-ol is 130.13577 g/mol.
Where can I buy 2,3,4-Trimethylpentan-2-ol?
You can request a quote for 2,3,4-Trimethylpentan-2-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2,3,4-Trimethylpentan-2-ol?
Yes, CoreyChem provides custom synthesis services for 2,3,4-Trimethylpentan-2-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.