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Methyl 3-(benzylsulfanyl)-2-methylpropanoate is a chemical compound with the molecular formula C12H16O2S. It is an organic ester derived from 2-methylpropanoic acid and benzylmercaptan. methyl 3-(benzylsulfanyl)-2-methylpropanoate is characterized by a methyl group attached to a 2-methylpropanoate backbone, with a benzylsulfanyl (benzylmercapto) group at the 3-position. It is a colorless liquid with a distinct odor and is soluble in organic solvents. Methyl 3-(benzylsulfanyl)-2-methylpropanoate is used in the synthesis of various pharmaceuticals and agrochemicals due to its unique chemical structure and reactivity. It is also employed as a flavoring agent and fragrance component in the food and cosmetics industries.

5331-04-4

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5331-04-4 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 5331-04-4 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 5,3,3 and 1 respectively; the second part has 2 digits, 0 and 4 respectively.
Calculate Digit Verification of CAS Registry Number 5331-04:
(6*5)+(5*3)+(4*3)+(3*1)+(2*0)+(1*4)=64
64 % 10 = 4
So 5331-04-4 is a valid CAS Registry Number.

5331-04-4SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 17, 2017

Revision Date: Aug 17, 2017

1.Identification

1.1 GHS Product identifier

Product name methyl 3-benzylsulfanyl-2-methylpropanoate

1.2 Other means of identification

Product number -
Other names methyl 3-(benzylthio)-2-methylpropanoate

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:5331-04-4 SDS

5331-04-4Relevant academic research and scientific papers

A simple method for in situ generation of thiols from thioacetates

Yelm, Kenneth E.

, p. 1101 - 1102 (1999)

Thioacetates were converted to thiols by treatment with pyrrolidine in a variety of solvents. Second order rate constants were measured for the reaction in acetonitrile, DMF, methylene chloride, and THF. Thiols generated in this manner have been alkylated in situ with alkyl halides and α,β- unsaturated carbonyl compounds, providing a convenient way to produce various sulfides.

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