O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate
TL;DR: O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate (CAS 7332-32-3) is a chemical compound with molecular formula C9H12ClO3PS2 and molecular weight 297.97 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-chloro-4-(dimethoxyphosphorylsulfanylmethylsulfanyl)benzene
Also Known As: PO-Methyltrithion, PO-Methyl trithion, Methyl trithion O-analog, O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate, 1-chloro-4-(dimethoxyphosphorylsulfanylmethylsulfanyl)benzene
| Molecular Formula | C9H12ClO3PS2 |
|---|---|
| Molecular Weight | 297.97 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 86.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 297.9654 |
| Heavy Atoms | 16 |
| Complexity | 239.0 |
Chemical Identifiers
| CAS Number | 7332-32-3 |
|---|---|
| SMILES | COP(=O)(OC)SCSC1=CC=C(C=C1)Cl |
| InChIKey | KCIJDUZGOXCCHB-UHFFFAOYSA-N |
Product Overview
O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate (CAS 7332-32-3), with molecular formula C9H12ClO3PS2 and molecular weight 297.97 g/mol. IUPAC: 1-chloro-4-(dimethoxyphosphorylsulfanylmethylsulfanyl)benzene.
Chemical Property Profile of O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate
Property Insights of O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate
The XLogP value of 3.1 indicates that O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.1 Ų falls within the moderate polarity range, balancing permeability and solubility for O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate. Following Lipinski's Rule of Five, O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate 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 O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate?
The CAS number of O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate is 7332-32-3.
What is the molecular formula of O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate?
The molecular formula of O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate is C9H12ClO3PS2.
What is the molecular weight of O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate?
The molecular weight of O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate is 297.97 g/mol.
Where can I buy O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate?
You can request a quote for O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate?
Yes, KEHONG BIO provides custom synthesis services for O,O-dimethyl S-(((4-chlorophenyl)thio)methyl) phosphorothioate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.