3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol
TL;DR: 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol (CAS 126665-15-4) is a chemical compound with molecular formula C13H20OS and molecular weight 224.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-1-(4-methylphenyl)sulfanylpentan-3-ol
Also Known As: 3-methyl-1-(p-tolylthio)pentan-3-ol, 5-[(4-Methylphenyl)thio]-3-methylpentan-3-ol, 3-methyl-1-(4-methylphenyl)sulfanyl-pentan-3-ol, 3-methyl-1-[(4-methylphenyl)sulfanyl]pentan-3-ol
| Molecular Formula | C13H20OS |
|---|---|
| Molecular Weight | 224.12 g/mol |
| LogP | 3.63822 |
| Topological Polar Surface Area | 20.23 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 224.12349 |
| Heavy Atoms | 15 |
| Complexity | 289.90918 |
Chemical Identifiers
| CAS Number | 126665-15-4 |
|---|---|
| SMILES | CCC(C)(CCSC1=CC=C(C=C1)C)O |
Product Overview
3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol (CAS 126665-15-4), with molecular formula C13H20OS and molecular weight 224.12 g/mol. IUPAC: 3-methyl-1-(4-methylphenyl)sulfanylpentan-3-ol.
Chemical Property Profile of 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol
Property Insights of 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol
The XLogP value of 3.63822 indicates that 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.23 Ų, 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol 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 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol?
The CAS number of 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol is 126665-15-4.
What is the molecular formula of 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol?
The molecular formula of 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol is C13H20OS.
What is the molecular weight of 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol?
The molecular weight of 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol is 224.12 g/mol.
Where can I buy 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol?
You can request a quote for 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-1-(4-methylphenyl)sulfanylpentan-3-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.