Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester
TL;DR: Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester (CAS 7533-79-1) is a chemical compound with molecular formula C10H12Cl2IO3PS and molecular weight 439.87 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,5-dichloro-4-iodophenoxy)-diethoxy-sulfanylidene-λ5-phosphane
Also Known As: Ciba C 8874, Ciba 8874, OMS 1210, AI3-27409, C 8874
| Molecular Formula | C10H12Cl2IO3PS |
|---|---|
| Molecular Weight | 439.87 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 439.86667 |
| Heavy Atoms | 18 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 7533-79-1 |
|---|---|
| SMILES | CCOP(=S)(OCC)OC1=CC(=C(C=C1Cl)I)Cl |
| InChIKey | GXEPRTHEHNIAKD-UHFFFAOYSA-N |
Product Overview
Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester (CAS 7533-79-1), with molecular formula C10H12Cl2IO3PS and molecular weight 439.87 g/mol. IUPAC: (2,5-dichloro-4-iodophenoxy)-diethoxy-sulfanylidene-λ5-phosphane.
Chemical Property Profile of Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester
Property Insights of Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester
The XLogP value of 6.2 indicates that Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.8 Ų, Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester?
The CAS number of Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester is 7533-79-1.
What is the molecular formula of Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester?
The molecular formula of Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester is C10H12Cl2IO3PS.
What is the molecular weight of Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester?
The molecular weight of Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester is 439.87 g/mol.
Where can I buy Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester?
You can request a quote for Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Phosphorothioic acid, O-(2,5-dichloro-4-iodophenyl) O,O-diethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.