Triethylene glycol, monothio, S-hexyl
TL;DR: Triethylene glycol, monothio, S-hexyl (CAS 87385-54-4) is a chemical compound with molecular formula C12H26O3S and molecular weight 250.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[2-(2-hexylsulfanylethoxy)ethoxy]ethanol
Also Known As: Triethylene glycol, monothio, S-hexyl, 3,6-Dioxa-9-thia-1-pentadecanol, Triethylene glycol,monothio,S-hexyl, 2-[2-(2-hexylsulfanylethoxy)ethoxy]ethanol, 2-[2-(2-hexylthioethoxy)ethoxy]ethan-1-ol
| Molecular Formula | C12H26O3S |
|---|---|
| Molecular Weight | 250.16 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 64.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 250.16026 |
| Heavy Atoms | 16 |
| Complexity | 123.0 |
Chemical Identifiers
| CAS Number | 87385-54-4 |
|---|---|
| SMILES | CCCCCCSCCOCCOCCO |
| InChIKey | WRKMHGBLFGTHHZ-UHFFFAOYSA-N |
Product Overview
Triethylene glycol, monothio, S-hexyl (CAS 87385-54-4), with molecular formula C12H26O3S and molecular weight 250.16 g/mol. IUPAC: 2-[2-(2-hexylsulfanylethoxy)ethoxy]ethanol.
Chemical Property Profile of Triethylene glycol, monothio, S-hexyl
Property Insights of Triethylene glycol, monothio, S-hexyl
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triethylene glycol, monothio, S-hexyl. The TPSA of 64.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Triethylene glycol, monothio, S-hexyl. Following Lipinski's Rule of Five, Triethylene glycol, monothio, S-hexyl has 1 hydrogen bond donor(s) and 4 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 Triethylene glycol, monothio, S-hexyl?
The CAS number of Triethylene glycol, monothio, S-hexyl is 87385-54-4.
What is the molecular formula of Triethylene glycol, monothio, S-hexyl?
The molecular formula of Triethylene glycol, monothio, S-hexyl is C12H26O3S.
What is the molecular weight of Triethylene glycol, monothio, S-hexyl?
The molecular weight of Triethylene glycol, monothio, S-hexyl is 250.16 g/mol.
Where can I buy Triethylene glycol, monothio, S-hexyl?
You can request a quote for Triethylene glycol, monothio, S-hexyl directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Triethylene glycol, monothio, S-hexyl?
Yes, KEHONG BIO provides custom synthesis services for Triethylene glycol, monothio, S-hexyl and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.