2,2'-(Dodecane-1,12-diylbis(thio))bisethanol
TL;DR: 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol (CAS 41891-96-7) is a chemical compound with molecular formula C16H34O2S2 and molecular weight 322.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[12-(2-hydroxyethylsulfanyl)dodecylsulfanyl]ethanol
Also Known As: EINECS 255-577-3, 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol, 2,2'-[dodecane-1,12-diylbis ]bisethanol, 2,2'-[Dodecane-1,12-diylbis(thio)]bisethanol, 2-[12-(2-hydroxyethylsulfanyl)dodecylsulfanyl]ethanol
| Molecular Formula | C16H34O2S2 |
|---|---|
| Molecular Weight | 322.20 g/mol |
| LogP | 4.3384 |
| Topological Polar Surface Area | 40.46 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 17 |
| Exact Mass | 322.2 |
| Heavy Atoms | 20 |
| Complexity | 150.55586 |
Chemical Identifiers
| CAS Number | 41891-96-7 |
|---|---|
| SMILES | C(CCCCCCSCCO)CCCCCSCCO |
Product Overview
2,2'-(Dodecane-1,12-diylbis(thio))bisethanol (CAS 41891-96-7), with molecular formula C16H34O2S2 and molecular weight 322.20 g/mol. IUPAC: 2-[12-(2-hydroxyethylsulfanyl)dodecylsulfanyl]ethanol.
Chemical Property Profile of 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol
Property Insights of 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol
The XLogP value of 4.3384 indicates that 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 40.46 Ų, 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2'-(Dodecane-1,12-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'-(Dodecane-1,12-diylbis(thio))bisethanol?
The CAS number of 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol is 41891-96-7.
What is the molecular formula of 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol?
The molecular formula of 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol is C16H34O2S2.
What is the molecular weight of 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol?
The molecular weight of 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol is 322.20 g/mol.
Where can I buy 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol?
You can request a quote for 2,2'-(Dodecane-1,12-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'-(Dodecane-1,12-diylbis(thio))bisethanol?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-(Dodecane-1,12-diylbis(thio))bisethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.