2,2'-(Octane-1,8-diylbis(thio))bisethanol
TL;DR: 2,2'-(Octane-1,8-diylbis(thio))bisethanol (CAS 58593-33-2) is a chemical compound with molecular formula C12H26O2S2 and molecular weight 266.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[8-(2-hydroxyethylsulfanyl)octylsulfanyl]ethanol
Also Known As: 2,2'-(Octane-1,8-diylbis(thio))bisethanol, 2,2'-[octane-1,8-diylbis(thio)]bisethanol, 2,2 -(Octamethylenebisthio)diethanol, 2,2'-[octane-1,8-diylbis ]bisethanol, 1,8-Bis-(2-hydroxy-aethylmercapto)-octan
| Molecular Formula | C12H26O2S2 |
|---|---|
| Molecular Weight | 266.14 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 91.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 266.13742 |
| Heavy Atoms | 16 |
| Complexity | 110.0 |
Chemical Identifiers
| CAS Number | 58593-33-2 |
|---|---|
| SMILES | C(CCCCSCCO)CCCSCCO |
| InChIKey | RFWDYENQLCEITI-UHFFFAOYSA-N |
Product Overview
2,2'-(Octane-1,8-diylbis(thio))bisethanol (CAS 58593-33-2), with molecular formula C12H26O2S2 and molecular weight 266.14 g/mol. IUPAC: 2-[8-(2-hydroxyethylsulfanyl)octylsulfanyl]ethanol.
Chemical Property Profile of 2,2'-(Octane-1,8-diylbis(thio))bisethanol
Property Insights of 2,2'-(Octane-1,8-diylbis(thio))bisethanol
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2'-(Octane-1,8-diylbis(thio))bisethanol. The TPSA of 91.1 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-(Octane-1,8-diylbis(thio))bisethanol. Following Lipinski's Rule of Five, 2,2'-(Octane-1,8-diylbis(thio))bisethanol has 2 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 2,2'-(Octane-1,8-diylbis(thio))bisethanol?
The CAS number of 2,2'-(Octane-1,8-diylbis(thio))bisethanol is 58593-33-2.
What is the molecular formula of 2,2'-(Octane-1,8-diylbis(thio))bisethanol?
The molecular formula of 2,2'-(Octane-1,8-diylbis(thio))bisethanol is C12H26O2S2.
What is the molecular weight of 2,2'-(Octane-1,8-diylbis(thio))bisethanol?
The molecular weight of 2,2'-(Octane-1,8-diylbis(thio))bisethanol is 266.14 g/mol.
Where can I buy 2,2'-(Octane-1,8-diylbis(thio))bisethanol?
You can request a quote for 2,2'-(Octane-1,8-diylbis(thio))bisethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-(Octane-1,8-diylbis(thio))bisethanol?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-(Octane-1,8-diylbis(thio))bisethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.