Chlorthion

Base Information

• Chemical Name: Chlorthion
• CAS No.: 500-28-7
• Molecular Formula: C8H9 Cl N O5 P S
• Molecular Weight: 297.656
• Hs Code.: 2920190090
• European Community (EC) Number: 207-902-5
• NSC Number: 8927
• UNII: 3NTK55T19G
• DSSTox Substance ID: DTXSID9041784
• Nikkaji Number: J152.065B
• Wikidata: Q27257781
• ChEMBL ID: CHEMBL160606
• Mol file: 500-28-7.mol

Synonyms:Chlorthion;500-28-7;Chlorthion methyl;Chlortion;Methyl chlorothion;CHLOROTHION;Chloorthion;Methylchlorothion;Compound 22/190;Bayer 22/190;BAY 22190;OMS 217;Chlortion [Czech];p-Nitro-m-chlorophenyl dimethyl thionophosphate;Chloorthion [Dutch];O,O-Dimethyl p-nitro-m-chlorophenyl thiophosphate;Caswell No. 201;ENT 18,861;O,O-Dimethyl O-(3-chloro-4-nitrophenyl) thiophosphate;Dimethyl 3-chloro-4-nitrophenyl thionophosphate;O,O-Dimethyl O-(3-chloro-4-nitrophenyl) phosphorothioate;O-(3-Chloro-4-nitrophenyl) O,O-dimethyl phosphorothioate;NSC 8927;O,O-Dimethyl O-4-nitro-3-chlorophenyl thiophosphate;3-Chloro-4-nitrophenyl dimethyl phosphorothioate;HSDB 979;Phosphorothioic acid, O-(3-chloro-4-nitrophenyl) O,O-dimethyl ester;O-(3-Chloro-4-nitrophenyl) O,O-dimethyl thiophosphate;O-(3-Cloro-4-nitro-fenil)-O,O-dimetil-monotiofosfato;O,O-Dimethyl-O-(3-chlor-4-nitrophenyl)-monothiophosphat;O,O-Dimethyl-O-3-chlor-4-nitrofenyltiofosfat;EINECS 207-902-5;EPA Pesticide Chemical Code 034501;BRN 2292513;Phenol, 3-chloro-4-nitro-, O-ester with O,O-dimethyl phosphorothioate;UNII-3NTK55T19G;AI3-18861;3NTK55T19G;O-(3-Chlor-4-nitro-phenyl)-O,O-dimethyl-monothiophosphat;Thiophosphate de O,O-dimethyle et de O-3-chloro-4-nitrophenyle;NSC-8927;Chlorthion 10 microg/mL in Isooctane;Chlorthion 100 microg/mL in Toluene;O,O-Dimethyl-O-3-chlor-4-nitrofenyltiofosfat [Czech];O,O-Dimethyl-O-(4-nitro-5-chlorphenyl)-thionophosphat;O-(3-Chloor-4-nitro-fenyl)-O,O-dimethyl-monothiofosfaat;O,O-Dimethyl-O-(4-nitro-5-chlorphenyl)-thionophosphat [German];(3-chloro-4-nitrophenoxy)-dimethoxy-sulfanylidene-lambda5-phosphane;O,O-Dimethyl-O-(3-chlor-4-nitrophenyl)-monothiophosphat [German];O,O-Dimethyl-O-3-chlor-4-nitrofenylester kyseliny thiofosforecne;O-(3-Chloor-4-nitro-fenyl)-O,O-dimethyl-monothiofosfaat [Dutch];O-(3-Chlor-4-nitro-phenyl)-O,O-dimethyl-monothiophosphat [German];O-(3-Cloro-4-nitro-fenil)-O,O-dimetil-monotiofosfato [Italian];O,O-Dimethyl-O-3-chlor-4-nitrofenylester kyseliny thiofosforecne [Czech];Thiophosphate de O,O-dimethyle et de O-3-chloro-4-nitrophenyle [French];O-(3-Chloro-4-nitro-fenyl)-O,O-dimethyl-monothiofosfaat;(3-chloro-4-nitrophenoxy)-dimethoxy-sulfanylidene-?^{5}-phosphane;CHLORTHION [MI];C8H9ClNO5PS;CHLOROTHION [HSDB];SCHEMBL475929;CHEMBL160606;DTXSID9041784;NSC8927;OMS-217;CHEBI:167184;WLN: WNR BG DOPS&O1&O1;BAY 22/190;LS-108468;FT-0774777;3-chloro-4-nitrophenyldimethylphosphorothioate;Chlorthion, PESTANAL(R), analytical standard;A934615;Phenol, 0-ester with 0,0-dimethyl phosphorothioate;Q27257781;O,O-dimethyl O-(3-chloro-4-nitrophenyl) thionophosphate;O-(3-Chloro-4-nitrophenyl) O,O-dimethyl thiophosphate #;O,O-DIMETHYL O-(3-CHLORO-4-NITROPHENYL)THIONOPHOSPHATE;O,O-DIMETHYL O-3-CHLORO-4-NITROPHENYL PHOSPHOROTHIOATE;O-3-CHLORO-4-NITROPHENYL O,O-DIMETHYL PHOSPHOROTHIOATE;O,O-dimethyl-O-(3-chloro-4-nitrophenyl)thio-phosphate, chlorthion;phosphorothioic acid O-(3-chloro-4-nitrophenyl) O,O-dimethyl ester;PHOSPHOROTHIOIC ACID, O-(3-CHLORO-4-NITROPHENYL) O,O-DI-ME ESTER

Chemical Property of Chlorthion

Chemical Property:

• Vapor Pressure: 3.06E-05mmHg at 25°C
• Melting Point: 21°
• Refractive Index: nD20 1.5661
• Boiling Point: 366.6°Cat760mmHg
• Flash Point: 175.5°C
• PSA: 115.41000
• Density: 1.499g/cm³
• LogP: 4.31810
• Storage Temp.: 2-8°C
• Water Solubility.: 40mg/L(20 oC)
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 4
• Exact Mass: 296.9627583
• Heavy Atom Count: 17
• Complexity: 318

Purity/Quality:

98%min ^*data from raw suppliers

Chlorthion ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xn,N
• Hazard Codes: Xn,N
• Statements: 20/21/22-50/53
• Safety Statements: 13-60-61

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Pesticides -> Organophosphate Insecticides
• Canonical SMILES: COP(=S)(OC)OC1=CC(=C(C=C1)[N+](=O)[O-])Cl
• Uses: Insecticide.

Technology Process of Chlorthion

There total 2 articles about Chlorthion 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:

3-chloro-4-nitrophenol (491-11-2) + dimethyl chlorothiophosphate (2524-03-0) → chlorothion (500-28-7)

Guidance literature:

With copper; potassium carbonate; butanone;

Reference yield:

→ chlorothion (500-28-7)

Guidance literature:

Reference yield:

chlorothion (500-28-7) → thiophosphoric acid O-(4-amino-3-chloro-phenyl ester)-O',O''-dimethyl ester (100313-80-2)

Guidance literature:

With ammonium chloride; zinc;

upstream raw materials:

3-chloro-4-nitrophenol

dimethyl chlorothiophosphate

Downstream raw materials:

thiophosphoric acid O-(4-amino-3-chloro-phenyl ester)-O',O''-dimethyl ester

Refernces

• 1、 -. "Alkyl 4-[o-(substituted methyleneamino)phenyl]-3-thioallophanates". . . Retrieved 2008/06/13.