4-tert-Butylbenzyl alcohol
TL;DR: 4-tert-Butylbenzyl alcohol (CAS 877-65-6) 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.
(4-tert-butylphenyl)methanol
Also Known As: 4-TERT-BUTYLBENZYL ALCOHOL, (4-(tert-Butyl)phenyl)methanol, (4-tert-Butylphenyl)methanol, 4-t-butylbenzyl alcohol, p-tert-Butylbenzyl alcohol
Application Areas
Top 5 of 16 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C11H16O |
| Molecular Weight | 164.12012 g/mol |
| XLogP | 2.9 |
| Topological Polar Surface Area (TPSA) | 20.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 164.12012 Da |
| Heavy Atoms | 12 |
| Complexity | 126.0 |
| SMILES | CC(C)(C)C1=CC=C(C=C1)CO |
| InChIKey | FVEINXLJOJPHLH-UHFFFAOYSA-N |
Product Description
Applications: 4-tert-Butylbenzyl alcohol is used in pharmaceutical synthesis routes and API production, as well as polymer chemistry and functional materials synthesis. 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, 4-tert-Butylbenzyl alcohol (CAS 877-65-6) has the molecular formula C11H16O and a molecular weight of 164.12 g/mol. Synonyms include 4-TERT-BUTYLBENZYL ALCOHOL and (4-(tert-Butyl)phenyl)methanol.
Custom synthesis (mg to ton scale), HPLC/NMR/MS analytical support, and complete COA/MSDS documentation are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
Chemical Property Profile of 4-tert-Butylbenzyl alcohol
Property Insights of 4-tert-Butylbenzyl alcohol
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-tert-Butylbenzyl alcohol. With a topological polar surface area (TPSA) of 20.2 Ų, 4-tert-Butylbenzyl alcohol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-tert-Butylbenzyl alcohol 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 4-tert-Butylbenzyl alcohol?
The CAS number of 4-tert-Butylbenzyl alcohol is 877-65-6.
What is the molecular formula of 4-tert-Butylbenzyl alcohol?
The molecular formula of 4-tert-Butylbenzyl alcohol is C11H16O.
What is the molecular weight of 4-tert-Butylbenzyl alcohol?
The molecular weight of 4-tert-Butylbenzyl alcohol is 164.12012 g/mol.
What are the applications of 4-tert-Butylbenzyl alcohol?
4-tert-Butylbenzyl alcohol is used in pharmaceutical synthesis routes and API production, as well as polymer chemistry and functional materials synthesis. 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 4-tert-Butylbenzyl alcohol?
You can request a quote for 4-tert-Butylbenzyl alcohol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-tert-Butylbenzyl alcohol?
Yes, CoreyChem provides custom synthesis services for 4-tert-Butylbenzyl alcohol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.