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2-Thioxo-1,3-dimethyl-1H-imidazole is an organic compound with the chemical formula C5H7N2S. It is a derivative of imidazole, a heterocyclic aromatic organic compound containing two nitrogen atoms and one sulfur atom. 2-Thioxo-1,3-dimethyl-1H-imidazole is characterized by its thioxo group (C=S) at the 2-position and two methyl groups (CH3) at the 1 and 3 positions. It is a colorless solid with a melting point of 90-92°C and is soluble in organic solvents. 2-Thioxo-1,3-dimazole is used as an intermediate in the synthesis of various pharmaceuticals, agrochemicals, and other chemical products. It is also known for its potential antifungal and antibacterial properties.

6596-81-2

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6596-81-2 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 6596-81-2 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 6,5,9 and 6 respectively; the second part has 2 digits, 8 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 6596-81:
(6*6)+(5*5)+(4*9)+(3*6)+(2*8)+(1*1)=132
132 % 10 = 2
So 6596-81-2 is a valid CAS Registry Number.
InChI:InChI=1/C5H8N2S/c1-6-3-4-7(2)5(6)8/h3-4H,1-2H3

6596-81-2SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 14, 2017

Revision Date: Aug 14, 2017

1.Identification

1.1 GHS Product identifier

Product name 1,3-dimethylimidazole-2-thione

1.2 Other means of identification

Product number -
Other names 1,3-(N,N(1))-dimethylimidazoline-2-thione

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:6596-81-2 SDS

6596-81-2Relevant academic research and scientific papers

METHOD FOR ALKYLATING A MOLECULE OR AN ION

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Page/Page column 34, (2019/04/16)

The present invention relates to a method for alkylating a molecule or an ion, wherein the molecule or the ion is alkylated by reacting it with an alkylating agent, wherein the alkylating agent is a compound according to formula (1) or a compound according to formula (4). In the formulae (1) and (4), R1 is a substituted C1-20-alkyl group, an unsubstituted C1-20-alkyl group, a substituted C3-20-cycloalkyl group or an unsubstituted C3-20-cycloaalkyl group, R2 is a substituted or unsubstituted C1-20 hydrocarbon residue or a hydrogen atom, R3 is a substituted or unsubstituted C1-20 hydrocarbon residue or a hydrogen atom, R4 and R5 are linked with each other to form an aromatic group or are independently from each other selected from the group consisting of a hydrogen atom, substituted and unsubstituted C1-20 hydrocarbon residues and electron withdrawing groups, R10 to R13 are independently from each other selected from the group consisting of a hydrogen atom, a substituted C1-20-alkyl group, an unsubstituted C1-20-alkyl group, a substituted C3-20-cycloalkyl group and an unsubstituted C3-20-cycloaalkyl group and A- is an anion.

THE CHELETROPIC FRAGMENTATION OF HYPERVALENT THREE-MEMBERED THIAHETEROCYCLIC INTERMEDIATES

Zoller, Uri

, p. 7413 - 7426 (2007/10/02)

Lithio-imidazolium salts 10, generated in-situ from N'N-dimethylimidazolium salts 9, readily undergo sulfonylation with sulfur dioxide, sulfines, N-sulfinylamines, and thiirane.The resulting zwitterionic species 4 fragment thermally to yield the corresponding imidazolium thione 5 with the hypervalent three-membered thiaheterocyclic intermediates 3 connecting 4 and 5 on the reaction surface.The non-linear cheletropic fragmentation of these relatively stable hypervalent sulfuranes appears to be general for this class of compounds (3 or 4), and the experimental results are in accord with theoretical considerations.

PHOTOCHEMISTRY OF AZOLES, PART VII. PHOTOSOLVOLYSIS OF ALKYLMERCAPTOAZOLES. AN APPLICATION TO SOME ACYCLIC MONOTERPENE DERIVATIVES

Iwasaki, Shigeo

, p. 125 - 138 (2007/10/02)

Salts derived from 2-alkylmercapto-1-methylimidazoles 1b-e and 3-alkylmercapto-4-methyl-1,2,4-triazoles 2b-d have been found to undergo photochemical heterolytic fission of the S-alkyl bond in aqueous or methanolic solution to give solvolysis-type products.

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