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2-(trichloromethyl)-1,3-dithiolane, with the molecular formula C3H3Cl3S, is a colorless liquid chemical compound characterized by a strong, unpleasant odor. Its trichloromethyl group endows it with reactivity, which is a key feature in its applications, but also makes it potentially toxic, necessitating careful handling and adherence to safety protocols.

5616-59-1

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5616-59-1 Usage

Uses

Used in Pharmaceutical Industry:
2-(trichloromethyl)-1,3-dithiolane serves as an intermediate in the synthesis of various organic compounds, particularly in the pharmaceutical sector. Its reactivity, stemming from the trichloromethyl group, allows for the creation of a wide range of pharmaceutical products, contributing to the development of new medications and therapies.
Used in Chemical Industry:
Within the chemical industry, 2-(trichloromethyl)-1,3-dithiolane is utilized in the synthesis of a variety of organic compounds for different applications. Its unique properties make it a valuable component in the production of specialty chemicals, highlighting its versatility in chemical processes.
Safety Considerations:
Given the potential toxicity associated with the trichloromethyl group, it is crucial to handle 2-(trichloromethyl)-1,3-dithiolane with caution. Proper safety protocols, including the use of personal protective equipment and adherence to guidelines for chemical management, are essential to minimize the risk of exposure and ensure the safe handling of 2-(trichloromethyl)-1,3-dithiolane.

Check Digit Verification of cas no

The CAS Registry Mumber 5616-59-1 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,6,1 and 6 respectively; the second part has 2 digits, 5 and 9 respectively.
Calculate Digit Verification of CAS Registry Number 5616-59:
(6*5)+(5*6)+(4*1)+(3*6)+(2*5)+(1*9)=101
101 % 10 = 1
So 5616-59-1 is a valid CAS Registry Number.
InChI:InChI=1/C4H5Cl3S2/c5-4(6,7)3-8-1-2-9-3/h3H,1-2H2

5616-59-1SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 16, 2017

Revision Date: Aug 16, 2017

1.Identification

1.1 GHS Product identifier

Product name 2-(trichloromethyl)-1,3-dithiolane

1.2 Other means of identification

Product number -
Other names -

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:5616-59-1 SDS

5616-59-1Downstream Products

5616-59-1Relevant academic research and scientific papers

A Variable Mechanism for the Nucleophilic Vinylic Substitutions in a Series of gem-Dihalogenated Alkenes by a Bidentate Sulfur Nucleophile: An Experimental and AM1 Theoretical Study

Gimbert, Yves,Moradpour, Alec,Dive, Georges,Dehareng, Dominique,Lahlil, Khaled

, p. 4685 - 4690 (1993)

The nucleophilic substitutions of a series of gem-dihalogenated alkenes 3, 5, 7, 8, and 9 (RS)2C=CX2 (X = Cl, F) with 1,2-benzenedithiolate b have been studied.Depending on the structures of the R groups (alkyl, saturated and unsaturated cycloalkyls, aromatic ring), the course of the reactions and the structures of the yielded products are modified.In the frame of the addition-elimination-type mechanism for these nucleophilic substitutions, the energy contents of the anionic intermediates, resulting from the additions of the nucleophile b to the unsaturated centers,is calculated at the AM1 method level.For the compounds 5, 7, 8, and 9, the calculated energies nicely corroborate the experimental results.For 3, anionic intetrmediates are no longer found by calculation, and a synchronous single-step substitution is strongly suggested.

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