(tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride
TL;DR: (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride (CAS 104114-64-9) is a chemical compound with molecular formula C11H17Cl4HgOPS and molecular weight 569.9198 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[tert-butyl(phenyl)phosphoryl]-chloro-methylsulfanium;mercury(2+);trichloride
Also Known As: Isonimolide, KST-1A0625, [tert-butyl(phenyl)phosphoryl](chloro)methylsulfonium mercury chloride(1:1:3), (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury( 2) cation trichloride, (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride
Technical Specifications
| Molecular Formula | C11H17Cl4HgOPS |
| Molecular Weight | 569.9198 g/mol |
| XLogP | -5.2001 |
| Topological Polar Surface Area (TPSA) | 18.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 569.9198 Da |
| Heavy Atoms | 19 |
| Complexity | 256.0 |
| SMILES | CC(C)(C)P(=O)(C1=CC=CC=C1)[S+](C)Cl.[Cl-].[Cl-].[Cl-].[Hg+2] |
| InChIKey | BJFNVOIDUCBKCW-UHFFFAOYSA-K |
Chemical Property Profile of (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride
Property Insights of (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride
The XLogP value of -5.2001 indicates that (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 18.1 Ų, (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride?
The CAS number of (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride is 104114-64-9.
What is the molecular formula of (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride?
The molecular formula of (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride is C11H17Cl4HgOPS.
What is the molecular weight of (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride?
The molecular weight of (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride is 569.9198 g/mol.
Where can I buy (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride?
You can request a quote for (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride?
Yes, CoreyChem provides custom synthesis services for (tert-Butylphenylphosphoryl)chloro-methylsulfanium mercury(2) cation trichloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.