5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol
TL;DR: 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol (CAS 69279-00-1) is a chemical compound with molecular formula C12H18OS and molecular weight 210.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol
Also Known As: Phenol, 2-(1,1-dimethylethyl)-5-methyl-, sulfides, 5-methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol
| Molecular Formula | C12H18OS |
|---|---|
| Molecular Weight | 210.11 g/mol |
| LogP | 4.3 |
| Topological Polar Surface Area | 21.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 210.10783 |
| Heavy Atoms | 14 |
| Complexity | 191.0 |
Chemical Identifiers
| CAS Number | 69279-00-1 |
|---|---|
| SMILES | CCC(C)(C)C1=C(C=C(C(=C1)S)C)O |
| InChIKey | WPPILGXFGJZLTM-UHFFFAOYSA-N |
Product Overview
5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol (CAS 69279-00-1), with molecular formula C12H18OS and molecular weight 210.11 g/mol. IUPAC: 5-methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol.
Chemical Property Profile of 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol
Property Insights of 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol
The XLogP value of 4.3 indicates that 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 21.2 Ų, 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol 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
Frequently Asked Questions
What is the CAS number of 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol?
The CAS number of 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol is 69279-00-1.
What is the molecular formula of 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol?
The molecular formula of 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol is C12H18OS.
What is the molecular weight of 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol?
The molecular weight of 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol is 210.11 g/mol.
Where can I buy 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol?
You can request a quote for 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol?
Yes, KEHONG BIO provides custom synthesis services for 5-Methyl-2-(2-methylbutan-2-yl)-4-sulfanylphenol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.