2-Methyl-4-phenyl-2-butanol
TL;DR: 2-Methyl-4-phenyl-2-butanol (CAS 103-05-9) is a chemical compound with molecular formula C11H16O and molecular weight 164.12012 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-methyl-4-phenylbutan-2-ol
Also Known As: 2-Methyl-4-phenyl-2-butanol, 2-Methyl-4-phenylbutan-2-ol, Benzyl-tert-butanol, Benzyl-t-butanol, muguet carbinol
Application Areas
Top 5 of 17 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H16O |
| Molecular Weight | 164.12012 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 164.12012 Da |
| Heavy Atoms | 12 |
| Complexity | 123.0 |
| Melting Point | 29 - 30 °C |
| Density | 0.960-0.966 |
| Refractive Index | 1.506-1.512 |
| Solubility | Soluble in fats; Slightly soluble in water |
| SMILES | CC(C)(CCC1=CC=CC=C1)O |
| InChIKey | YXVSKJDFNJFXAJ-UHFFFAOYSA-N |
Chemical Property Profile of 2-Methyl-4-phenyl-2-butanol
Property Insights of 2-Methyl-4-phenyl-2-butanol
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Methyl-4-phenyl-2-butanol. With a topological polar surface area (TPSA) of 20.2 Ų, 2-Methyl-4-phenyl-2-butanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Methyl-4-phenyl-2-butanol 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-Methyl-4-phenyl-2-butanol?
The CAS number of 2-Methyl-4-phenyl-2-butanol is 103-05-9.
What is the molecular formula of 2-Methyl-4-phenyl-2-butanol?
The molecular formula of 2-Methyl-4-phenyl-2-butanol is C11H16O.
What is the molecular weight of 2-Methyl-4-phenyl-2-butanol?
The molecular weight of 2-Methyl-4-phenyl-2-butanol is 164.12012 g/mol.
Where can I buy 2-Methyl-4-phenyl-2-butanol?
You can request a quote for 2-Methyl-4-phenyl-2-butanol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Methyl-4-phenyl-2-butanol?
Yes, CoreyChem provides custom synthesis services for 2-Methyl-4-phenyl-2-butanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.