4-Tert-butyl-2-methoxyphenol
TL;DR: 4-Tert-butyl-2-methoxyphenol (CAS 37987-27-2) is a chemical compound with molecular formula C11H16O2 and molecular weight 180.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-tert-butyl-2-methoxyphenol
Also Known As: 4-tert-butyl-2-methoxyphenol, 4-tert-Butylguajacol, 4-(tert-butyl)-2-methoxyphenol, 5-t-butyl-2-hydroxyanisole, 2-Methoxy-4-tert-butylphenol
| Molecular Formula | C11H16O2 |
|---|---|
| Molecular Weight | 180.12 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 29.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 180.11504 |
| Heavy Atoms | 13 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 37987-27-2 |
|---|---|
| SMILES | CC(C)(C)C1=CC(=C(C=C1)O)OC |
| InChIKey | SERZNTMEVJWJSA-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
4-Tert-butyl-2-methoxyphenol (CAS 37987-27-2), with molecular formula C11H16O2 and molecular weight 180.12 g/mol. IUPAC: 4-tert-butyl-2-methoxyphenol.
Chemical Property Profile of 4-Tert-butyl-2-methoxyphenol
Property Insights of 4-Tert-butyl-2-methoxyphenol
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Tert-butyl-2-methoxyphenol. With a topological polar surface area (TPSA) of 29.5 Ų, 4-Tert-butyl-2-methoxyphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Tert-butyl-2-methoxyphenol has 1 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 4-Tert-butyl-2-methoxyphenol?
The CAS number of 4-Tert-butyl-2-methoxyphenol is 37987-27-2.
What is the molecular formula of 4-Tert-butyl-2-methoxyphenol?
The molecular formula of 4-Tert-butyl-2-methoxyphenol is C11H16O2.
What is the molecular weight of 4-Tert-butyl-2-methoxyphenol?
The molecular weight of 4-Tert-butyl-2-methoxyphenol is 180.12 g/mol.
Where can I buy 4-Tert-butyl-2-methoxyphenol?
You can request a quote for 4-Tert-butyl-2-methoxyphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Tert-butyl-2-methoxyphenol?
Yes, KEHONG BIO provides custom synthesis services for 4-Tert-butyl-2-methoxyphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.