Phosphorodithioic acid, S-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester
TL;DR: Phosphorodithioic acid, S-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester (CAS 64050-56-2) is a chemical compound with molecular formula C9H12ClO2PS3 and molecular weight 313.94 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-chlorophenyl)sulfanylmethylsulfanyl-dimethoxy-sulfanylidene-λ5-phosphane
Also Known As: Geigy G-35163, ENT 25,652, G 35163, S-(((3-Chlorophenyl)thio)methyl) O,O-dimethyl phosphorodithioate, s-{[(3-chlorophenyl)sulfanyl]methyl} o,o-dimethyl phosphorodithioate
| Molecular Formula | C9H12ClO2PS3 |
|---|---|
| Molecular Weight | 313.94 g/mol |
| LogP | 4.8 |
| Topological Polar Surface Area | 101.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 313.94257 |
| Heavy Atoms | 16 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 64050-56-2 |
|---|---|
| SMILES | COP(=S)(OC)SCSC1=CC(=CC=C1)Cl |
| InChIKey | LKQNSSGSQQSDOG-UHFFFAOYSA-N |
Product Overview
Phosphorodithioic acid, S-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester (CAS 64050-56-2), with molecular formula C9H12ClO2PS3 and molecular weight 313.94 g/mol. IUPAC: (3-chlorophenyl)sulfanylmethylsulfanyl-dimethoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphorodithioic acid, S-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester
Property Insights of Phosphorodithioic acid, S-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester
The XLogP value of 4.8 indicates that Phosphorodithioic acid, S-(((m-chlorophenyl)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-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester. Following Lipinski's Rule of Five, Phosphorodithioic acid, S-(((m-chlorophenyl)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-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester?
The CAS number of Phosphorodithioic acid, S-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester is 64050-56-2.
What is the molecular formula of Phosphorodithioic acid, S-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester?
The molecular formula of Phosphorodithioic acid, S-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester is C9H12ClO2PS3.
What is the molecular weight of Phosphorodithioic acid, S-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester?
The molecular weight of Phosphorodithioic acid, S-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester is 313.94 g/mol.
Where can I buy Phosphorodithioic acid, S-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester?
You can request a quote for Phosphorodithioic acid, S-(((m-chlorophenyl)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-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorodithioic acid, S-(((m-chlorophenyl)thio)methyl) O,O-dimethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.