Butanedioic acid, ((dimethoxyphosphinothioyl)thio)-, monoethyl ester

Base Information

• Chemical Name: Butanedioic acid, ((dimethoxyphosphinothioyl)thio)-, monoethyl ester
• CAS No.: 1642-51-9
• Deprecated CAS: 26445-72-7
• Molecular Formula: C₈H₁₅O₆PS₂
• Molecular Weight: 302.309
• DSSTox Substance ID: DTXSID80274247
• Nikkaji Number: J545.238D
• Mol file: 1642-51-9.mol

Synonyms:Malathion monocarboxylic acid;1642-51-9;35884-76-5;MALATHION MONOACID;Butanedioic acid, ((dimethoxyphosphinothioyl)thio)-, monoethyl ester;MALATHION BETA-MONOACID;3-Dimethoxyphosphinothioylsulfanyl-4-ethoxy-4-oxobutanoic acid;Monoethyl ((dimethoxyphosphinothioyl)thio)butanedioate;Butanedioic acid, ((dimethoxyphosphinothioyl)thio)-, 1-ethyl ester;Malathionbeta-Monoacid;Malathion beta-carboxylic acid;SCHEMBL4008080;DTXSID80274247;FT-0774589;3-(dimethoxyphosphorothioylthio)-4-ethoxy-4-oxobutanoic acid;Butanedioic acid, 2-[(dimethoxyphosphinothioyl)thio]-, monoethyl ester

Chemical Property of Butanedioic acid, ((dimethoxyphosphinothioyl)thio)-, monoethyl ester

Chemical Property:

• Boiling Point: 401.1°Cat760mmHg
• PKA: 3.73±0.19(Predicted)
• Flash Point: 196.4°C
• PSA: 149.26000
• Density: 1.388g/cm³
• LogP: 2.29390
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 9
• Exact Mass: 302.00476754
• Heavy Atom Count: 17
• Complexity: 313

Purity/Quality:

Malathionβ-Monoacid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)C(CC(=O)O)SP(=S)(OC)OC

Technology Process of Butanedioic acid, ((dimethoxyphosphinothioyl)thio)-, monoethyl ester

There total 1 articles about Butanedioic acid, ((dimethoxyphosphinothioyl)thio)-, monoethyl ester 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:

→ malathion alpha-monocarboxylic acid (1642-51-9)

Guidance literature:

entspr. Dithiophosphorsaeure, Ethylhydrogenmaleat/Pyridin/Erhitzen;

DOI:10.1021/jf60202a043