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5-Dodecylthio[1,3,4]thiadiazole-2-thiol is a chemical compound with the molecular formula C15H23N2S3. It is a derivative of the thiadiazole ring system, which is a five-membered heterocyclic compound containing two nitrogen atoms and one sulfur atom. The compound features a dodecyl (C12H25) alkyl chain attached to the thiadiazole ring through a sulfur atom, and a thiol (-SH) group at the 2-position of the thiadiazole ring. This molecule is known for its potential applications in various fields, such as pharmaceuticals, agrochemicals, and materials science, due to its unique chemical structure and properties. It can be used as a building block for the synthesis of more complex molecules or as a reagent in chemical reactions.

4858-31-5

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4858-31-5 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 4858-31-5 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,8,5 and 8 respectively; the second part has 2 digits, 3 and 1 respectively.
Calculate Digit Verification of CAS Registry Number 4858-31:
(6*4)+(5*8)+(4*5)+(3*8)+(2*3)+(1*1)=115
115 % 10 = 5
So 4858-31-5 is a valid CAS Registry Number.

4858-31-5SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 20, 2017

Revision Date: Aug 20, 2017

1.Identification

1.1 GHS Product identifier

Product name 5-dodecylsulfanyl-3H-1,3,4-thiadiazole-2-thione

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

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More Details:4858-31-5 SDS

4858-31-5Relevant academic research and scientific papers

Metal-free and green synthesis of a series of new bis(2-alkylsulfanyl-[1,3,4]thiadiazolyl)-5,5′-disulfides and 2,2′-Dibenzothiazyl disulfide via oxidative self-coupling using hydrogen peroxide

Ching Juan, Joon,Ghaffari Khaligh, Nader,Heidelberg, Thorsten,Ling Ong, Chiu

, (2021/12/29)

Many disulfide and 1,3,4-thiadiazole-1,2-dithiol compounds have been extensively investigated in the pharmaceutical industry due to their unique biological properties. A series of new bis(2-alkylsulfanyl-[1,3,4]thiadiazolyl)-5,5′-disulfide derivatives containing two 1,3,4-thiadiazole rings linked by S[sbnd]S bond spacer were synthesized via the oxidative self-coupling of 5-alkylsulfanyl-[1,3,4]thiadiazole-2-thiol using hydrogen peroxide and ethanol as green oxidant and solvent, respectively. The excellent yields of 93–97% with 100% conversion were achieved with a simple one-pot synthesis. There is no over-oxidation of 5-alkylsulfanyl-[1,3,4]thiadiazole-2-thiol and 2-mercaptobenzothiadiazole that leads to the formation of by-products such as thiosulfinate, thiosulfonate, and sulfonic acid. In this process, a straightforward, short reaction time, metal-free, reusable solvent, and mild reaction conditions are applied to produce bis(2-alkylsulfanyl-[1,3,4]thiadiazolyl)-5,5′-disulfides and 2,2′-dibenzothiazyl disulfide. Therefore, the oxidative self-coupling is potential for other disulfide compounds.

S,S'-and S,N-Disubstituted Derivatives of 1,3,4-Thiadiazoledithiones

Katritzky, Alan R.,Wang, Zouquan,Offerman, Rick J.

, p. 139 - 142 (2007/10/02)

Facile synthesis of 2-n-dodecylthio-4-phenylthiomethyl-1,3,4-thiadiazole-5-thione 6, starting from 2,5-dimercaptothiadiazole via 2-n-dodecylthio-1,3,4-thiadiazole-5-thione 2, 2-n-dodecylthio-4-hydroxymethyl-1,3,4-thiadiazole-5-thione 4 and 2-n-dodecylthio-4-chloromethyl-1,3,4-thiadiazole-5-thione 5 is described.

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