N-(Methyl)mercaptoacetamide - ≥95% , CAS No.20938-74-3

CAS: 20938-74-3 Cat. No.: M124593 Fórmula: C₃H₇NOS Peso molecular: 105.16 Beilstein Registry Number: 1740652 Número CE: 629-060-1

GRADE & PURITY ≥95%

Synonyms

CHEBI:38731 | A919357 | N-methyl-2-mercaptoacetamide | SCHEMBL314398 | Z1203730878 | Q27117967 | EN300-200189 | Acetamide, 2-mercapto-N-methyl- | J-013729 | NoName_1671 | thioglycolic methylamide | 2-mercapto-N-methylacetamide | MFCD00042981 | n-methyl-me

Storage

Store at 2-8°C

Shipped In

Wet ice

Visão geral

A mild reducing agent for methionine sulfoxide

Specifications

Sinónimos

CHEBI:38731 | A919357 | N-methyl-2-mercaptoacetamide | SCHEMBL314398 | Z1203730878 | Q27117967 | EN300-200189 | Acetamide, 2-mercapto-N-methyl- | J-013729 | NoName_1671 | thioglycolic methylamide | 2-mercapto-N-methylacetamide | MFCD00042981 | n-methyl-me

Especificações e pureza

≥95%

Mecanismos bioquímicos e fisiológicos

N-(Methyl)mercaptoacetamide is a reducing agent that reacts with methionine sulfoxide moieties. N-(Methyl)mercaptoacetamide may be used as a reference material in assays wherein this molecule is an expected leaving group. N-(Methyl)mercaptoacetamide is us

Condições de armazenamento de armazenamento

Store at 2-8°C

Enviado em

Wet ice

Este produto requer transporte de cadeia fria. Serviços terrestres e outros serviços econômicos não estão disponíveis.

Pureza

≥95%

Nomes e identificadores

Pubchem Sid

504762811

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504762811

Sorrisos canónicos

CNC(=O)CS

IUPAC Name

N-methyl-2-sulfanylacetamide

InChIKey

NSJNRJYQQPRCLF-UHFFFAOYSA-N

INCHI

1S/C3H7NOS/c1-4-3(5)2-6/h6H,2H2,1H3,(H,4,5)

SMILES isoméricas

CNC(=O)CS

WGK Alemanha

3

Peso molecular

105.16

Beilstein

1740652

Reaxy-Rn

1740652

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1740652&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic acids and derivatives
    • Classe Carboxylic acids and derivatives
      • Subclass Carboxylic acid derivatives
        • Level5 Carboxylic acid amides
          • Level6 Secondary carboxylic acid amides

• Kingdom: Organic compounds
• Superclass: Organic acids and derivatives
• Classe: Carboxylic acids and derivatives
• Subclass: Carboxylic acid derivatives
• Intermediate Tree Nodes: Carboxylic acid amides
• Direct Parent: Secondary carboxylic acid amides
• Alternative Parents: Alkylthiols Organopnictogen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Secondary carboxylic acid amide - Alkylthiol - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organosulfur compound - Organooxygen compound - Organonitrogen compound - Carbonyl group - Aliphatic acyclic compound
• Descrição: This compound belongs to the class of organic compounds known as secondary carboxylic acid amides. These are compounds containing a secondary carboxylic acid amide functional group, with the general structure RC(=O)N(R')H (R,R'=alkyl, aryl).
• External Descriptors: monocarboxylic acid amide

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Propriedades químicas e físicas

• Sensibilidade: Air sensitive
• Índice de refração: 1.523
• Ponto de ebulição (°C): 83-85°C/0.3mmHg
• Peso molecular: 105.160 g/mol
• XLogP3: -0.100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 105.025 Da
• Monoisotopic Mass: 105.025 Da
• Topological Polar Surface Area: 30.100 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 54.800
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1