Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester
TL;DR: Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester (CAS 141931-26-2) is a chemical compound with molecular formula C9H21OPS3 and molecular weight 272.04922 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[tert-butylsulfanyl(methylsulfanyl)phosphoryl]sulfanyl-2-methylpropane
Also Known As: S,S-Di-tert-butyl S-methyl phosphorotrithioate, Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester, 2-[tert-butylsulfanyl(methylsulfanyl)phosphoryl]sulfanyl-2-methylpropane, 2-methyl-2-(methylsulfanyl-tert-butylsulfanyl-phosphoryl)sulfanyl-propane
Technical Specifications
| Molecular Formula | C9H21OPS3 |
| Molecular Weight | 272.04922 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 93.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 272.04922 Da |
| Heavy Atoms | 14 |
| Complexity | 207.0 |
| SMILES | CC(C)(C)SP(=O)(SC)SC(C)(C)C |
| InChIKey | OSQPQWWARRASKN-UHFFFAOYSA-N |
Chemical Property Profile of Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester
Property Insights of Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester. The TPSA of 93.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester. Following Lipinski's Rule of Five, Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester?
The CAS number of Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester is 141931-26-2.
What is the molecular formula of Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester?
The molecular formula of Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester is C9H21OPS3.
What is the molecular weight of Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester?
The molecular weight of Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester is 272.04922 g/mol.
Where can I buy Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester?
You can request a quote for Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester?
Yes, CoreyChem provides custom synthesis services for Phosphorotrithioic acid, S,S-bis(1,1-dimethylethyl) S-methyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.