structure of 2-(Diethylamino)ethanethiol

2-(Diethylamino)ethanethiol

CAS No.: 100-38-9
M. Wt: 133.255
M. Fa: C6H15NS
InChI Key: YBDSNEVSFQMCTL-UHFFFAOYSA-N

Names and Identifiers of 2-(Diethylamino)ethanethiol

CAS Number

100-38-9

EC Number

202-846-8

IUPAC Name

2-(diethylamino)ethanethiol

InChI

InChI=1S/C6H15NS/c1-3-7(4-2)5-6-8/h8H,3-6H2,1-2H3

InChIKey

YBDSNEVSFQMCTL-UHFFFAOYSA-N

Canonical SMILES

CCN(CC)CCS

UNII

TF6S7Q84YD

Physical and chemical properties of 2-(Diethylamino)ethanethiol

Boiling Point

161.6±23.0 °C at 760 mmHg

Density

0.9±0.1 g/cm3

Exact Mass

133.092514

Flash Point

51.5±22.6 °C

Index of Refraction

1.469

LogP

1.82

Melting Point

127-129 °C(lit.)

Molecular Formula

C6H15NS

Molecular Weight

133.255

PSA

42.04000

Vapour Pressure

2.3±0.3 mmHg at 25°C

Safety Information of 2-(Diethylamino)ethanethiol

Pictograms

Signal Word

Danger

Safety Data Sheet

Supports customized editing of SDS information and downloading in PDF documents.

Applications of 2-(Diethylamino)ethanethiol

2-(Diethylamino)ethanethiol finds applications in various fields:

  • Chemical Synthesis: It serves as a reagent in organic synthesis, particularly in the modification of polymers and the production of thioether compounds.
  • Pharmaceuticals: Its derivatives are explored for potential therapeutic applications due to their biological activity.
  • Chemical Research: Used as a model compound in studies related to electrochemistry and reaction mechanisms involving thiols.

Interaction Studies of 2-(Diethylamino)ethanethiol

Studies have investigated the interactions of 2-(Diethylamino)ethanethiol with various substrates and biological systems. For example:

  • Electrochemical Behavior: Research has focused on its oxidation processes, revealing insights into its reactivity and stability under different conditions.
  • Biological Interactions: Investigations into its neurotoxic properties have highlighted potential risks associated with exposure, particularly in contexts related to chemical warfare agents.

These studies contribute to understanding how this compound behaves in both synthetic and biological environments.

Biological Activity of 2-(Diethylamino)ethanethiol

Research indicates that 2-(Diethylamino)ethanethiol may exhibit biological activity relevant to pharmacology and toxicology. It is noted as a precursor for compounds that can affect neurotransmitter systems and has been studied for its potential neurotoxic effects related to nerve agents. The compound's ability to interact with biological systems makes it significant in both medicinal chemistry and toxicological studies.

Retrosynthesis analysis of 2-(Diethylamino)ethanethiol

  • Route#1

    Cas:100-35-6
    Cas:100-38-9
  • Route#2

    Cas:100-37-8
    Cas:100-38-9
  • Route#3

    Cas:64-17-5
    Cas:78-53-5
    Cas:100-38-9