Chlorthiophos III
TL;DR: Chlorthiophos III (CAS 77503-28-7) 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.
(2,4-dichloro-5-methylsulfanylphenoxy)-diethoxy-sulfanylidene-λ5-phosphane
Also Known As: Chlorthiophos iii, Phosphorothioic acid, O-(2,4-dichloro-5-(methylthio)phenyl) O,O-diethyl ester, (2,4-dichloro-5-methylsulfanylphenoxy)-diethoxy-sulfanylidene-, O-(2,4-DICHLORO-5-(METHYLSULFANYL)PHENYL) O,O-DIETHYL PHOSPHOROTHIOATE, O-[2,4-Dichloro-5-(methylsulfanyl)phenyl] O,O-diethyl phosphorothioate
| 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 |
Chemical Identifiers
| CAS Number | 77503-28-7 |
|---|---|
| SMILES | CCOP(=S)(OCC)OC1=CC(=C(C=C1Cl)Cl)SC |
| InChIKey | WIQNXNHXIZXZFM-UHFFFAOYSA-N |
Product Overview
Chlorthiophos III (CAS 77503-28-7), with molecular formula C11H15Cl2O3PS2 and molecular weight 359.96 g/mol. IUPAC: (2,4-dichloro-5-methylsulfanylphenoxy)-diethoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Chlorthiophos III
Property Insights of Chlorthiophos III
The XLogP value of 6.0 indicates that Chlorthiophos III 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 III. Following Lipinski's Rule of Five, Chlorthiophos III 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 III?
The CAS number of Chlorthiophos III is 77503-28-7.
What is the molecular formula of Chlorthiophos III?
The molecular formula of Chlorthiophos III is C11H15Cl2O3PS2.
What is the molecular weight of Chlorthiophos III?
The molecular weight of Chlorthiophos III is 359.96 g/mol.
Where can I buy Chlorthiophos III?
You can request a quote for Chlorthiophos III directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Chlorthiophos III?
Yes, KEHONG BIO provides custom synthesis services for Chlorthiophos III and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.