Isoxathion

Base Information

• Chemical Name: Isoxathion
• CAS No.: 18854-01-8
• Molecular Formula: C13H16 N O4 P S
• Molecular Weight: 313.314
• Hs Code.: 29349990
• European Community (EC) Number: 242-624-8
• UNII: IRA3YFG6CX
• DSSTox Substance ID: DTXSID0042080
• Nikkaji Number: J3.456H
• Wikipedia: Isoxathion
• Wikidata: Q426373
• Metabolomics Workbench ID: 55032
• ChEMBL ID: CHEMBL3182191
• Mol file: 18854-01-8.mol

Synonyms:ISOXATHION;18854-01-8;Karphos;Isoxathion [ISO:BSI];O,O-Diethyl O-(5-phenyl-3-isoxazolyl) phosphorothioate;O,O-Diethyl O-5-phenylisoxazol-3-ylphosphorothioate;Isoxathion [BSI:JMAF:ISO];SI-6711;O,O-Diethyl O-(3-(5-phenyl)-1,2-isoxazolyl)phosphorothionate;E-48;HSDB 6692;IRA3YFG6CX;UNII-IRA3YFG6CX;EINECS 242-624-8;Phosphorothioic acid, O,O-diethyl O-(5-phenyl-3-isoxazolyl) ester;BRN 1222135;DTXSID0042080;CHEBI:34801;Isoxathion 10 microg/mL in Cyclohexane;O,O-diethyl O-(5-phenylisoxazol-3-yl) thiophosphate;O,O-diethyl O-(5-phenyl-1,2-oxazol-3-yl) phosphorothionate;diethoxy-[(5-phenyl-1,2-oxazol-3-yl)oxy]-sulfanylidene-lambda5-phosphane;diethoxy-[(5-phenyl-1,2-oxazol-3-yl)oxy]-sulfanylidene-?^{5}-phosphane;ISOXATHION [ISO];ISOXATHION [HSDB];SCHEMBL26734;BIDD:ER0065;C13H16NO4PS;Isoxathion, analytical standard;CHEMBL3182191;DTXCID8022080;SDMSCIWHRZJSRN-UHFFFAOYSA-;HMS1786D21;C13-H16-N-O4-P-S;Tox21_302209;MFCD00210313;AKOS005167093;NCGC00255850-01;CAS-18854-01-8;LS-108707;Diethyl-(5-phenyl-3-isoxazolyl)-thiophosphate;Q426373;O,O-Diethyl-O-(5-phenylisoxazol-3-yl)thiophosphate;O,O-diethyl O-5-phenylisoxazol-3-yl phosphorothioate;o,o-diethyl-o-(5-phenyl-3-isoxazolyl)phosphorothioate;diethoxy-[(5-phenyl-1,2-oxazol-3-yl)oxy]-sulfanylidenephosphorane;O,O-DIETHYL O-5-PHENYL-1,2-OXAZOL-3-YL PHOSPHOROTHIOATE;Phosphorothioic acid O,O-diethyl O-(5-phenyl-3-isoxazolyl) ester;Phosphorothioic acid, O,O-diethyl O-(5-phenyl-3-isoxazoyl)ester

Chemical Property of Isoxathion

Chemical Property:

• Vapor Pressure: 7.3E-07mmHg at 25°C
• Melting Point: <25℃
• Boiling Point: 419.6°Cat760mmHg
• PKA: -6.17±0.28(Predicted)
• Flash Point: 207.6°C
• PSA: 95.62000
• Density: 1.258g/cm³
• LogP: 4.66850
• Storage Temp.: 0-6°C
• Solubility.: Chloroform (Slightly), Methanol (Slightly)
• Water Solubility.: 1.9 mg l-1 (25 °C)
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 7
• Exact Mass: 313.05376616
• Heavy Atom Count: 20
• Complexity: 328

Purity/Quality:

99.9% ^*data from raw suppliers

Isoxathion ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T,N
• Statements: 24/25-50/53
• Safety Statements: 28-36/37-45-60-61

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Pesticides -> Organophosphate Insecticides
• Canonical SMILES: CCOP(=S)(OCC)OC1=NOC(=C1)C2=CC=CC=C2
• Description: Isoxathion is a pale yellow liquid, bp 160 ?C/0.15 mm Hg, vp <0.133mPa (25 ?C). Solubility in water is 1.9 mg/L (25 ?C). It is readily soluble in most organic solvents. Log Kow = 3.88. It is unstable to alkali.
• Uses: Isoxathion is used to control sucking pests, leaf miners and some chewing pests in a variety of fruit, vegetables and ornamental plants. Isoxathion is used as a pesticide.

Technology Process of Isoxathion

There total 1 articles about Isoxathion which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ O,O-diethyl O-5-phenylisoxazol-3-yl phosphorothioate (18854-01-8)

Guidance literature:

entspr.Isoxazol II/entspr.P-Cl-Verb.;

Refernces