Chlorthiophos I
TL;DR: Chlorthiophos I (CAS 60238-56-4) is a chemical compound with molecular formula C11H15Cl2O3PS2 and molecular weight 359.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dichloro-4-methylsulfanylphenoxy)-diethoxy-sulfanylidene-λ5-phosphane
Also Known As: CHLORTHIOPHOS, Chlorthiophos I, Celathion, Celamerck S-2957, Caswell No. 310A
| Molecular Formula | C11H15Cl2O3PS2 |
|---|---|
| Molecular Weight | 359.96 g/mol |
| LogP | 6.0 |
| Topological Polar Surface Area | 85.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 359.95773 |
| Heavy Atoms | 19 |
| Complexity | 312.0 |
| Boiling Point | 307 to 157.8 °C at 0.013 mmHg |
| Density | 1.345 at 20.0 °C |
| Solubility | Practically insol in water, sol in most organic solvents |
| Vapor Pressure | 0.0004 mmHg at 25.0 °C |
Chemical Identifiers
| CAS Number | 60238-56-4 |
|---|---|
| SMILES | CCOP(=S)(OCC)OC1=CC(=C(C=C1Cl)SC)Cl |
| InChIKey | JAZJVWLGNLCNDD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Chlorthiophos I (CAS 60238-56-4), with molecular formula C11H15Cl2O3PS2 and molecular weight 359.96 g/mol. IUPAC: (2,5-dichloro-4-methylsulfanylphenoxy)-diethoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Chlorthiophos I
Property Insights of Chlorthiophos I
The XLogP value of 6.0 indicates that Chlorthiophos I is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.1 Ų falls within the moderate polarity range, balancing permeability and solubility for Chlorthiophos I. Following Lipinski's Rule of Five, Chlorthiophos I has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Chlorthiophos I?
The CAS number of Chlorthiophos I is 60238-56-4.
What is the molecular formula of Chlorthiophos I?
The molecular formula of Chlorthiophos I is C11H15Cl2O3PS2.
What is the molecular weight of Chlorthiophos I?
The molecular weight of Chlorthiophos I is 359.96 g/mol.
Where can I buy Chlorthiophos I?
You can request a quote for Chlorthiophos I directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chlorthiophos I?
Yes, KEHONG BIO provides custom synthesis services for Chlorthiophos I and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.