1-S,4-S-bis(2-ethylhexyl) butanebis(thioate)
TL;DR: 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate) (CAS 62268-47-7) is a chemical compound with molecular formula C20H38O2S2 and molecular weight 374.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-S,4-S-bis(2-ethylhexyl) butanebis(thioate)
Also Known As: Acetic acid, 2,2'-dithiobis-, bis(2-ethylhexyl) ester
| Molecular Formula | C20H38O2S2 |
|---|---|
| Molecular Weight | 374.23 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 84.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 17 |
| Exact Mass | 374.23132 |
| Heavy Atoms | 24 |
| Complexity | 300.0 |
Chemical Identifiers
| CAS Number | 62268-47-7 |
|---|---|
| SMILES | CCCCC(CC)CSC(=O)CCC(=O)SCC(CC)CCCC |
| InChIKey | VOSNPYPLJYTQHV-UHFFFAOYSA-N |
Product Overview
1-S,4-S-bis(2-ethylhexyl) butanebis(thioate) (CAS 62268-47-7), with molecular formula C20H38O2S2 and molecular weight 374.23 g/mol. IUPAC: 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate).
Chemical Property Profile of 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate)
Property Insights of 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate)
The XLogP value of 7.2 indicates that 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate). Following Lipinski's Rule of Five, 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate) has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate)?
The CAS number of 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate) is 62268-47-7.
What is the molecular formula of 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate)?
The molecular formula of 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate) is C20H38O2S2.
What is the molecular weight of 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate)?
The molecular weight of 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate) is 374.23 g/mol.
Where can I buy 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate)?
You can request a quote for 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate)?
Yes, KEHONG BIO provides custom synthesis services for 1-S,4-S-bis(2-ethylhexyl) butanebis(thioate) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.