Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride
TL;DR: Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride (CAS 50728-34-2) is a chemical compound with molecular formula C15H26ClNOS and molecular weight 303.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[6-(2-methylphenoxy)hexylamino]ethanethiol;hydrochloride
Also Known As: 2-((6-(o-Tolyloxy)hexyl)amino)ethanethiol hydrochloride, Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride, 2-[6-(2-methylphenoxy)hexylamino]ethanethiol,hydrochloride, 2-{[6-(2-methylphenoxy)hexyl]amino}ethanethiol hydrochloride(1:1), 2-[6-(2-methylphenoxy)hexylamino]ethanethiol hydrochloride
| Molecular Formula | C15H26ClNOS |
|---|---|
| Molecular Weight | 303.14 g/mol |
| LogP | 3.87542 |
| Topological Polar Surface Area | 22.3 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 10 |
| Exact Mass | 303.14236 |
| Heavy Atoms | 19 |
| Complexity | 189.0 |
Chemical Identifiers
| CAS Number | 50728-34-2 |
|---|---|
| SMILES | CC1=CC=CC=C1OCCCCCCNCCS.Cl |
| InChIKey | VPOCCJCAVCNUFN-UHFFFAOYSA-N |
Product Overview
Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride (CAS 50728-34-2), with molecular formula C15H26ClNOS and molecular weight 303.14 g/mol. IUPAC: 2-[6-(2-methylphenoxy)hexylamino]ethanethiol;hydrochloride.
Chemical Property Profile of Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride
Property Insights of Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride
The XLogP value of 3.87542 indicates that Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 22.3 Ų, Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride has 3 hydrogen bond donor(s) and 3 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 Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride?
The CAS number of Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride is 50728-34-2.
What is the molecular formula of Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride?
The molecular formula of Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride is C15H26ClNOS.
What is the molecular weight of Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride?
The molecular weight of Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride is 303.14 g/mol.
Where can I buy Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride?
You can request a quote for Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for Ethanethiol, 2-((6-(o-tolyloxy)hexyl)amino)-, hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.