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Methyl 2-methyl-3-mercaptopropionate, also known as 2-methyl-3-(methylthio)propanoic acid methyl ester, is an organic compound with the chemical formula C5H10O2S. It is a colorless liquid with a distinctive, strong odor. Methyl 2-methyl-3-mercaptopropionate is a derivative of propionic acid, featuring a methyl group (CH3) at the 2nd carbon and a mercapto group (SH) at the 3rd carbon. The esterification of the carboxylic acid group with methanol results in the formation of a methyl ester. Methyl 2-methyl-3-mercaptopropionate is used as a flavoring agent and a fragrance compound, adding depth and complexity to various food and cosmetic products. It is synthesized through chemical reactions and is known for its stability and reactivity, which makes it a valuable component in the creation of synthetic flavors and scents.

4131-76-4

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4131-76-4 Usage

Check Digit Verification of cas no

The CAS Registry Mumber 4131-76-4 includes 7 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 4 digits, 4,1,3 and 1 respectively; the second part has 2 digits, 7 and 6 respectively.
Calculate Digit Verification of CAS Registry Number 4131-76:
(6*4)+(5*1)+(4*3)+(3*1)+(2*7)+(1*6)=64
64 % 10 = 4
So 4131-76-4 is a valid CAS Registry Number.
InChI:InChI=1/C5H10O2S/c1-4(3-8)5(6)7-2/h4,8H,3H2,1-2H3

4131-76-4SDS

SAFETY DATA SHEETS

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

Version: 1.0

Creation Date: Aug 13, 2017

Revision Date: Aug 13, 2017

1.Identification

1.1 GHS Product identifier

Product name methyl 2-methyl-3-sulfanylpropanoate

1.2 Other means of identification

Product number -
Other names EINECS 223-949-4

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:4131-76-4 SDS

4131-76-4Downstream Products

4131-76-4Relevant academic research and scientific papers

A thioesterase for chemoselective hydrolysis of S-acyl sulfanylalkanoates.

Kumar,Jolly

, p. 283 - 285 (2007/10/03)

[figure: see text] A thioesterase, isolated from a strain of Alcaligenes sp. ISH108, chemoselectively hydrolyzes thiol esters. The application of the enzyme has been demonstrated in the preparation of the antihypertensive agent captopril.

Process Conditions for Production of D-β-Acetylthioisobutyric Acid from Methyl DL-β-Acetylthioisobutyrate with the Cells of Pseudomonas putida MR-2068

Sakimae, Akihiro,Ozaki, Eiji,Toyama, Hiroko,Ohsuga, Naoto,Numazawa, Ryozo,et al.

, p. 782 - 786 (2007/10/02)

The process conditions concerned with the production of D-β-acetylthioisobutyric acid were investigated.Methyl DL-β-acetylthioisobutyrate as an enzyme substrate was produced from methyl methacrylate in 96.6percent yield by allowing 1.0 mol of methyl methacrylate to react with 1.6 mol of thioacetic acid at 80 deg C for 6 h.Through the study of hydrolytic reaction of methyl DL-β-acetylthioisobutyrate with the cells of Pseudomonas putida MR-2068, it was found that D-β-acetylthioisobutyric acid having more than 98percent (e. e.) optical purity was obtained when the reaction was done below pH 7.5 and below 50 deg C.For example, 10percent (w/v) methyl DL-β-acetylthioisobutyrate in the reaction mixture was asymmetrically hydrolyzed by 0.2percent (w/v) cells at 45 deg C at pH 7.0 for 18 h to give DAT having 98.2percent (e. e.) optical purity in 49.7percent yield.To prevent the decomposition and racemization of D-β-acetylthioisobutyric acid in the purification process, the use of a thin-film distillation apparatus for a continuous distillation was proposed to be an effective purification method.

A NEW SYNTHESIS OF OPTICALLY ACTIVE β-MERCAPTOCARBOXYLIC ACID ESTERS

Shono, Tatsuya,Matsumura, Yoshihiro,Fujita, Tetsuhiro

, p. 6723 - 6726 (2007/10/02)

Synthesis of optically active β-mercaptocarboxylic acid esters has been achieved by a new method utilizing optically active N-methoxycarbonylpiperidine derivative as a template which can be prepared from L-lysine by anodic oxidation.

Stereocontrol in the Intramolecular Nitrone Cycloaddition to Vinyl Sulphur Derivatives.

Annunziata, Rita,Cinquini, Mauro,Cozzi, Franco,Giaroni, Paola,Raimondi, Laura

, p. 251 - 264 (2007/10/02)

The intramolecular cycloaddition to vinyl sulphur derivatives of a series of nitrones featuring an alkyl or alkoxy substituted α-stereocenter on the tether connecting dipol and dipolarophile occurs in a competely stereoselective fashion to give 3',3-anti configurated products.The synthetic potentialities of this reaction is illustrated by the synthesis of a precursor of (d)-biotin.

Amide carbamates and amide oxime compounds

-

, (2008/06/13)

Amide oxime compounds are useful intermediates in the preparation of pesticidally active amide carbamate compounds.

A Novel Method for the Preparation of Thioformates and Thiols by using Thioformimidates

Matsubara, Yoshio,Nakamura, Toshiyuki,Yoshihara, Masakuni,Maeshima, Toshihishi

, p. 3389 - 3391 (2007/10/02)

Several new S-alkylated thioformimidates were synthesized and their applications to the synthesis of thiolformates and thiols were investigated.Keywords - thioformimidates; thiols; thiolformates; thioformanilide; Michel-type addition

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