氯氧磷
TL;DR: 氯氧磷 (CAS 54593-83-8) is a chemical compound with molecular formula C6H11Cl4O3PS and molecular weight 333.89 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
氯氧磷
diethoxy-sulfanylidene-(1,2,2,2-tetrachloroethoxy)-λ5-phosphane
Also Known As: Chlorethoxyfos, Chlorethoxyphos, Chloroethoxyfos, Fortress, Chlorethoxyfos [ISO]
| Molecular Formula | C6H11Cl4O3PS |
|---|---|
| Molecular Weight | 333.89 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 59.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 335.8891 |
| Heavy Atoms | 15 |
| Complexity | 225.0 |
| Boiling Point | 80 °C @ 0.05 mm Hg |
| Density | 1.41 g/cu cm @ 20 °C |
| Solubility | Solubility in water, 3 ppm @ 20 °C /Technical/ |
| Flash Point | >230 °C |
| Vapor Pressure | 0.000795 [mmHg] |
| Refractive Index | 1.4980 @ 25 °C |
Chemical Identifiers
| CAS Number | 54593-83-8 |
|---|---|
| SMILES | CCOP(=S)(OCC)OC(C(Cl)(Cl)Cl)Cl |
| InChIKey | XFDJMIHUAHSGKG-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
氯氧磷 (CAS 54593-83-8), with molecular formula C6H11Cl4O3PS and molecular weight 333.89 g/mol. IUPAC: diethoxy-sulfanylidene-(1,2,2,2-tetrachloroethoxy)-λ5-phosphane.
Chemical Property Profile of 氯氧磷
Property Insights of 氯氧磷
The XLogP value of 4.6 indicates that 氯氧磷 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.8 Ų, 氯氧磷 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 氯氧磷 has 0 hydrogen bond donor(s) and 4 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 氯氧磷?
The CAS number of 氯氧磷 is 54593-83-8.
What is the molecular formula of 氯氧磷?
The molecular formula of 氯氧磷 is C6H11Cl4O3PS.
What is the molecular weight of 氯氧磷?
The molecular weight of 氯氧磷 is 333.89 g/mol.
Where can I buy 氯氧磷?
You can request a quote for 氯氧磷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 氯氧磷?
Yes, KEHONG BIO provides custom synthesis services for 氯氧磷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.