S,S-Dibutyl (butylsulfinyl)phosphonodithioate
TL;DR: S,S-Dibutyl (butylsulfinyl)phosphonodithioate (CAS 142635-81-2) is a chemical compound with molecular formula C12H27O2PS3 and molecular weight 330.0911 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-[butylsulfanyl(butylsulfinyl)phosphoryl]sulfanylbutane
Also Known As: S,S-Dibutyl (butylsulfinyl)phosphonodithioate, 1-[butylsulfanyl(butylsulfinyl)phosphoryl]sulfanylbutane, Phosphonodithioic acid, (butylsulfinyl)-, S,S-dibutyl ester, 1-(butylsulfanyl-butylsulfinyl-phosphoryl)sulfanylbutane
Technical Specifications
| Molecular Formula | C12H27O2PS3 |
| Molecular Weight | 330.0911 g/mol |
| XLogP | 3.4 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 330.0911 Da |
| Heavy Atoms | 18 |
| Complexity | 258.0 |
| SMILES | CCCCSP(=O)(SCCCC)S(=O)CCCC |
| InChIKey | HZEWOVCJTQOBAJ-UHFFFAOYSA-N |
Chemical Property Profile of S,S-Dibutyl (butylsulfinyl)phosphonodithioate
Property Insights of S,S-Dibutyl (butylsulfinyl)phosphonodithioate
The XLogP value of 3.4 indicates that S,S-Dibutyl (butylsulfinyl)phosphonodithioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for S,S-Dibutyl (butylsulfinyl)phosphonodithioate. Following Lipinski's Rule of Five, S,S-Dibutyl (butylsulfinyl)phosphonodithioate has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of S,S-Dibutyl (butylsulfinyl)phosphonodithioate?
The CAS number of S,S-Dibutyl (butylsulfinyl)phosphonodithioate is 142635-81-2.
What is the molecular formula of S,S-Dibutyl (butylsulfinyl)phosphonodithioate?
The molecular formula of S,S-Dibutyl (butylsulfinyl)phosphonodithioate is C12H27O2PS3.
What is the molecular weight of S,S-Dibutyl (butylsulfinyl)phosphonodithioate?
The molecular weight of S,S-Dibutyl (butylsulfinyl)phosphonodithioate is 330.0911 g/mol.
Where can I buy S,S-Dibutyl (butylsulfinyl)phosphonodithioate?
You can request a quote for S,S-Dibutyl (butylsulfinyl)phosphonodithioate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for S,S-Dibutyl (butylsulfinyl)phosphonodithioate?
Yes, CoreyChem provides custom synthesis services for S,S-Dibutyl (butylsulfinyl)phosphonodithioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.