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Phenylchloridothiophosphonic acid methyl ester, also known as O-Methyl Phenylphosphonochloridothioate, is an organophosphorus compound that serves as an intermediate in the synthesis of various chemical compounds. It is characterized by its unique chemical structure, which includes a phenyl group, a chloro group, a thiophosphonic acid group, and a methyl ester group. This versatile molecule has potential applications in various industries due to its chemical properties.

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  • 20147-96-0 Structure
  • Basic information

    1. Product Name: Phenylchloridothiophosphonic acid methyl ester
    2. Synonyms: Phenylchloridothiophosphonic acid methyl ester
    3. CAS NO:20147-96-0
    4. Molecular Formula: C7H8ClOPS
    5. Molecular Weight: 206.63
    6. EINECS: N/A
    7. Product Categories: N/A
    8. Mol File: 20147-96-0.mol
  • Chemical Properties

    1. Melting Point: N/A
    2. Boiling Point: 90 °C(Press: 0.005 Torr)
    3. Flash Point: N/A
    4. Appearance: /
    5. Density: 1.30±0.1 g/cm3(Predicted)
    6. Refractive Index: N/A
    7. Storage Temp.: N/A
    8. Solubility: N/A
    9. CAS DataBase Reference: Phenylchloridothiophosphonic acid methyl ester(CAS DataBase Reference)
    10. NIST Chemistry Reference: Phenylchloridothiophosphonic acid methyl ester(20147-96-0)
    11. EPA Substance Registry System: Phenylchloridothiophosphonic acid methyl ester(20147-96-0)
  • Safety Data

    1. Hazard Codes: N/A
    2. Statements: N/A
    3. Safety Statements: N/A
    4. WGK Germany:
    5. RTECS:
    6. HazardClass: N/A
    7. PackingGroup: N/A
    8. Hazardous Substances Data: 20147-96-0(Hazardous Substances Data)

20147-96-0 Usage

Uses

Used in Pesticide Synthesis:
Phenylchloridothiophosphonic acid methyl ester is used as an intermediate in the synthesis of Leptophos (L329655), an organophosphorus pesticide. It plays a crucial role in the production process, contributing to the development of this pesticide, which exhibits stronger endocrine-disrupting properties than its (+)form in JEG-3 cells.

Check Digit Verification of cas no

The CAS Registry Mumber 20147-96-0 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 2,0,1,4 and 7 respectively; the second part has 2 digits, 9 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 20147-96:
(7*2)+(6*0)+(5*1)+(4*4)+(3*7)+(2*9)+(1*6)=80
80 % 10 = 0
So 20147-96-0 is a valid CAS Registry Number.

20147-96-0SDS

SAFETY DATA SHEETS

According to Globally Harmonized System of Classification and Labelling of Chemicals (GHS) - Sixth revised edition

Version: 1.0

Creation Date: Aug 19, 2017

Revision Date: Aug 19, 2017

1.Identification

1.1 GHS Product identifier

Product name chloro-methoxy-phenyl-sulfanylidene-λ<sup>5</sup>-phosphane

1.2 Other means of identification

Product number -
Other names Phosphonochloridothioic acid,phenyl-,O-methyl ester

1.3 Recommended use of the chemical and restrictions on use

Identified uses For industry use only.
Uses advised against no data available

1.4 Supplier's details

1.5 Emergency phone number

Emergency phone number -
Service hours Monday to Friday, 9am-5pm (Standard time zone: UTC/GMT +8 hours).

More Details:20147-96-0 SDS

20147-96-0Relevant articles and documents

Kinetics and mechanism of the anilinolyses of O-methyl, O-propyl and O-isopropyl phenyl phosphonochloridothioates in acetonitrile

Barai, Hasi Rani,Hoque, Ehtesham Ul,Lee, Mijin,Lee, Hai Whang

, p. 1096 - 1100 (2013/07/28)

The kinetic studies on the reactions of O-methyl (1), O-propyl (3) and O-isopropyl (4) phenyl phosphonochloridothioates with substituted anilines and deuterated anilines have been carried out in acetonitrile at 55.0 °C. A concerted SN2 mechanism is proposed for the anilinolyses of 1, 3 and 4. The anilinolysis rates of the phosphonochloridothioates are predominantly dependent upon the steric effects over the inductive effects of the two ligands. The deuterium kinetic isotope effects (DKIEs; kH/kD) are primary normal with 1 and 3, while secondary inverse with 4. Primary normal and secondary inverse DKIEs are rationalized by frontside and backside nucleophilic attack transition state, respectively. The DKIEs of the phosphonochloridothioates do not have any consistent correlations with the two ligands.

A new convenient synthesis of phosphoro(-no)chloridothionates

He, Zheng-Jie,Liu, Ju-Xiang,Tang, Chu-Chi

, p. 2769 - 2772 (2007/10/03)

A general procedure for synthesis of phosphoro(-no)chlorides, particularly unsymmetrical ones, has been developed. The method involves the dealkylation of O,O-dialkyl phosphoro(-no)thionates 1 with dimethylamine and the chlorination of O-alkyl ammonium phosphoro(-no)thioates 2 using phosphorus oxychloride as a chlorinating agent.

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