Acethion

Base Information

• Chemical Name: Acethion
• CAS No.: 919-54-0
• Molecular Formula: C₈H₁₇O₄PS₂
• Molecular Weight: 272.326
• Hs Code.: 29309090
• UNII: LOW85U4E3X
• DSSTox Substance ID: DTXSID9041572
• Nikkaji Number: J31.842F
• Wikidata: Q2823836
• Mol file: 919-54-0.mol

Synonyms:ACETHION;919-54-0;Acethione;Ethoxyphas;Ethoxyphos;ethyl 2-diethoxyphosphinothioylsulfanylacetate;Hercules 4580;HSDB 2666;ENT 25650;UNII-LOW85U4E3X;BRN 1793592;LOW85U4E3X;AI3-25650;Ethyl ((diethoxyphosphinothioyl)thio)acetate;O,O-Diethyl S-carboethoxymethyl dithiophosphate;O,O-Diethyl S-carboethoxymethyl phosphorodithioate;Phosphorodithioic acid, O,O-diethyl ester, S-ester with ethyl mercaptoacetate;Acetic acid, ((diethoxyphosphinothioyl)thio)-, ethyl ester;Acetic acid, mercapto-, ethyl ester, S-ester with O,O-diethyl phosphorodithioate;Acetic acid, [(diethoxyphosphinothioyl)thio]-, ethyl ester;ACETHION [HSDB];SCHEMBL117924;DTXSID9041572;Acethion 100 microg/mL in Cyclohexane;ethyl 2-(diethoxyphosphorothioylthio)acetate;Q2823836;ETHYL 2-((DIETHOXYPHOSPHINOTHIOYL)THIO)ACETATE;S-(ETHOXYCARBONYLMETHYL) O,O-DIETHYL PHOSPHORODITHIOATE;ethyl 2-{[diethoxy(sulfanylidene)-??-phosphanyl]sulfanyl}acetate

Chemical Property of Acethion

Chemical Property:

• Vapor Pressure: 0.000591mmHg at 25°C
• Boiling Point: 310.7°Cat760mmHg
• Flash Point: 141.7°C
• PSA: 111.96000
• Density: 1.222g/cm³
• LogP: 3.23080
• XLogP3: 2.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 9
• Exact Mass: 272.03058836
• Heavy Atom Count: 15
• Complexity: 225

Purity/Quality:

99% ^*data from raw suppliers

ACETHION 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Pesticides -> Organophosphate Insecticides
• Canonical SMILES: CCOC(=O)CSP(=S)(OCC)OCC

Technology Process of Acethion

There total 2 articles about Acethion 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:

chloroacetic acid ethyl ester (105-39-5) + O,O-Diethyl hydrogen phosphorodithioate (298-06-6) → O,O-diethyl S-carboethoxymethyl phosphorodithioate (919-54-0)

Guidance literature:

With triethylamine; benzene;

Reference yield:

→ O,O-diethyl S-carboethoxymethyl phosphorodithioate (919-54-0)

Guidance literature:

Entspr. α-Halogenessigester, entspr. Natriumphosphat;

Reference yield:

O,O-diethyl S-carboethoxymethyl phosphorodithioate (919-54-0) → Dithiophosphoric acid O,O'-diethyl ester S-(5-thioxo-4-o-tolyl-4,5-dihydro-1H-[1,2,4]triazol-3-ylmethyl) ester

Guidance literature:

Multi-step reaction with 3 steps

1: 56 percent / NH₂NH₂*H₂O / ethanol / 72 h

2: 84 percent / ethanol / 3 h / Heating

3: 56 percent / NaOH / ethanol / 1 h / Heating

With sodium hydroxide; hydrazine hydrate; In ethanol;

upstream raw materials:

chloroacetic acid ethyl ester

O,O-Diethyl hydrogen phosphorodithioate