36038-77-4 Usage
Description
Propanoic acid, 2-Methyl-2-[(phenylMethyl)thio]is a chemical compound with the molecular formula C12H16O2S. It is a derivative of propanoic acid, known for its strong odor and is commonly used in the synthesis of pharmaceuticals, agrochemicals, and as a flavoring agent in the food industry. It also serves as an intermediate in organic synthesis and a solvent in various chemical reactions. Due to its potentially harmful nature if ingested or inhaled, it should be handled with caution.
Uses
Used in Pharmaceutical Industry:
Propanoic acid, 2-Methyl-2-[(phenylMethyl)thio]is used as a key intermediate in the synthesis of various pharmaceuticals for its unique chemical properties, contributing to the development of new drugs and therapies.
Used in Agrochemical Industry:
In the agrochemical industry, Propanoic acid, 2-Methyl-2-[(phenylMethyl)thio]is utilized as a building block in the creation of agrochemicals, helping to develop effective solutions for agricultural challenges.
Used as a Flavoring Agent in the Food Industry:
Leveraging its strong odor, Propanoic acid, 2-Methyl-2-[(phenylMethyl)thio]is employed as a flavoring agent in the food industry, enhancing the taste and aroma of various food products.
Used in Organic Synthesis:
Propanoic acid, 2-Methyl-2-[(phenylMethyl)thio]serves as an intermediate in organic synthesis, playing a crucial role in the formation of complex organic compounds for a wide range of applications.
Used as a Solvent in Chemical Reactions:
In various chemical reactions, Propanoic acid, 2-Methyl-2-[(phenylMethyl)thio]is used as a solvent, facilitating the process and enabling the successful completion of numerous chemical transformations.
Check Digit Verification of cas no
The CAS Registry Mumber 36038-77-4 includes 8 digits separated into 3 groups by hyphens. The first part of the number,starting from the left, has 5 digits, 3,6,0,3 and 8 respectively; the second part has 2 digits, 7 and 7 respectively.
Calculate Digit Verification of CAS Registry Number 36038-77:
(7*3)+(6*6)+(5*0)+(4*3)+(3*8)+(2*7)+(1*7)=114
114 % 10 = 4
So 36038-77-4 is a valid CAS Registry Number.
InChI:InChI=1/C11H14O2S/c1-11(2,10(12)13)14-8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3,(H,12,13)
36038-77-4Relevant articles and documents
Metal-assisted oxo atom addition to an fe(III) thiolate
Villar-Acevedo, Gloria,Lugo-Mas, Priscilla,Blakely, Maike N.,Rees, Julian A.,Ganas, Abbie S.,Hanada, Erin M.,Kaminsky, Werner,Kovacs, Julie A.
, p. 119 - 129 (2017)
Cysteinate oxygenation is intimately tied to the fonction of both cysteine dioxygenases (CDOs) and nitrile hydratases (NHases), and yet the mechanisms by which sulfurs are oxidized by these enzymes are unknown, in part because intermediates have yet to be
Mass Spectrometry of 2-Alkylthio-2-methylpropanoic Acids and Their Esters and Amides. Structural and Steric Effects on the McLafferty Rearrangement
Mori, Yuji,Fujiwara, Shigeru,Miyachi, Toshiko,Kitanishi, Hiroyuki,Oya, Masayuki,et al.
, p. 1505 - 1517 (2007/10/02)
The electron ionization mass spectra (MS) of S-methylated derivatives of N-(2-mercapto-2-methylpropanoyl)-L-cysteine and 2-alkylthio-2-methylpropanoic acids, as well as their esters and amides, were examined.Use of the deuterium labeling technique and accurate mass measurement supported the proposed fragmentation pathways.Extensive loss of CH2S from a molecular ion by the McLafferty rearrangementof a primary hydrogen is important in the MS of S-methyl compounds of amide derivatives.It was demonstrated that the intensity of the rearrangement ion decreases in the order of amide, ester, and acid, and in the case if amides the reaarangement is suppressed by the nonbonded interaction between methyl groups on the α carbon and the amide nitrogen.Keywords-N-(2-mercapto-2-methylpropanoyl)-L-cysteine; 2-alkylthio-2-methylpropanoic acid and methyl ester; 2-alkylthio-2-methylpropanamide; electron impact mass spectrometry; McLafferty rearrangement; steric interaction
