Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester
TL;DR: Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester (CAS 2984-78-3) is a chemical compound with molecular formula C6H11Cl2O2PS3 and molecular weight 311.90 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3-dichloroprop-1-enylsulfanylmethylsulfanyl-dimethoxy-sulfanylidene-λ5-phosphane
Also Known As: Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester
| Molecular Formula | C6H11Cl2O2PS3 |
|---|---|
| Molecular Weight | 311.90 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 311.9036 |
| Heavy Atoms | 14 |
| Complexity | 217.0 |
Chemical Identifiers
| CAS Number | 2984-78-3 |
|---|---|
| SMILES | COP(=S)(OC)SCSC=CC(Cl)Cl |
| InChIKey | FJXIYVJSEXZZTP-UHFFFAOYSA-N |
Product Overview
Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester (CAS 2984-78-3), with molecular formula C6H11Cl2O2PS3 and molecular weight 311.90 g/mol. IUPAC: 3,3-dichloroprop-1-enylsulfanylmethylsulfanyl-dimethoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester
Property Insights of Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester
The XLogP value of 3.9 indicates that Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester. Following Lipinski's Rule of Five, Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester 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
Frequently Asked Questions
What is the CAS number of Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester?
The CAS number of Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester is 2984-78-3.
What is the molecular formula of Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester?
The molecular formula of Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester is C6H11Cl2O2PS3.
What is the molecular weight of Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester?
The molecular weight of Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester is 311.90 g/mol.
Where can I buy Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester?
You can request a quote for Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorodithioic acid, S-(((3,3-dichloroallyl)thio)methyl) O,O-dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.