Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate
TL;DR: Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate (CAS 119395-97-0) is a chemical compound with molecular formula C6H5ClLi2NO3PS and molecular weight 250.97363 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
dilithium;(6-chloro-2-pyridinyl)methylsulfanyl-dioxido-oxo-λ5-phosphane
Also Known As: Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate, Phosphorothioic acid, S-(6-chloro-2-pyridinylmethyl) ester, dilithium salt, monohydrate, 2-Pyridinemethanethiol, 6-chloro-, dihydrogen phophate (ester), dilithium salt, hydrate, dilithium (6-chloropyridin-2-yl)methylsulfanyl-dioxido-oxo-, Dilithium S-[(6-chloropyridin-2-yl)methyl] phosphorothioate
Technical Specifications
| Molecular Formula | C6H5ClLi2NO3PS |
| Molecular Weight | 250.97363 g/mol |
| XLogP | -5.1951 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 250.97363 Da |
| Heavy Atoms | 15 |
| Complexity | 201.0 |
| SMILES | [Li+].[Li+].C1=CC(=NC(=C1)Cl)CSP(=O)([O-])[O-] |
| InChIKey | RIROXZKPCPBCFE-UHFFFAOYSA-L |
Chemical Property Profile of Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate
Property Insights of Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate
The XLogP value of -5.1951 indicates that Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate. Following Lipinski's Rule of Five, Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate 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 Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate?
The CAS number of Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate is 119395-97-0.
What is the molecular formula of Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate?
The molecular formula of Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate is C6H5ClLi2NO3PS.
What is the molecular weight of Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate?
The molecular weight of Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate is 250.97363 g/mol.
Where can I buy Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate?
You can request a quote for Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate?
Yes, CoreyChem provides custom synthesis services for Dilithium S-(6-chloro-2-pyridylmethyl)phosphorothioate hydrate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.