structure of 2-Ethylpyridine

2-Ethylpyridine

CAS No.: 100-71-0
M. Wt: 107.153
M. Fa: C7H9N
InChI Key: NRGGMCIBEHEAIL-UHFFFAOYSA-N
Appearance: Colorless to Almost colorless clear liquid

Names and Identifiers of 2-Ethylpyridine

CAS Number

100-71-0

EC Number

202-881-9

MDL Number

MFCD00006361

IUPAC Name

2-ethylpyridine

InChI

InChI=1S/C7H9N/c1-2-7-5-3-4-6-8-7/h3-6H,2H2,1H3

InChIKey

NRGGMCIBEHEAIL-UHFFFAOYSA-N

Canonical SMILES

CCC1=CC=CC=N1

UNII

06X1W46PYX

UNSPSC Code

12352100

Physical and chemical properties of 2-Ethylpyridine

Acidity coefficient

5.89(at 25℃)

Boiling Point

150.3±3.0 °C at 760 mmHg

BRN

106480

Density

0.9±0.1 g/cm3

Exact Mass

107.073502

Flash Point

29.4±0.0 °C

Index of Refraction

1.499

LogP

1.72

Melting Point

-63°C

Molecular Formula

C7H9N

Molecular Weight

107.153

PSA

12.89000

Solubility

42g/l

Storage condition

Flammables area

Vapour Pressure

4.89 [mmHg]

Water Solubility

ca 45 g/L (20 ºC)

Safety Information of 2-Ethylpyridine

Pictograms

Signal Word

Warning

Safety Data Sheet

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

Applications of 2-Ethylpyridine

2-Ethylpyridine finds applications across various fields:

  • Chemical Intermediate: It serves as an important intermediate in the synthesis of pharmaceuticals and agrochemicals.
  • Solvent: Due to its polar nature, it is used as a solvent in organic reactions.
  • Flavoring Agent: It is also utilized in small quantities as a flavoring agent in food products, although this use is limited due to safety regulations.

Interaction Studies of 2-Ethylpyridine

Interaction studies involving 2-ethylpyridine often focus on its effects on biological systems and its reactivity with other chemicals. For instance, investigations into its role as a cigarette smoke component have revealed its potential to induce oxidative stress and cellular damage. Furthermore, studies examining its interactions with various catalysts have demonstrated its utility in enhancing reaction efficiencies in synthetic processes.

Biological Activity of 2-Ethylpyridine

Research indicates that 2-ethylpyridine may have biological effects, particularly in relation to its presence in cigarette smoke. Studies have shown that it can cause mitochondrial damage in human retinal pigment epithelial cells, suggesting potential cytotoxic effects. Additionally, derivatives of 2-ethylpyridine have been investigated for their anti-tubercular properties, specifically inhibiting mycolic acid synthesis in Mycobacterium tuberculosis.

Physical sample testing spectrum (NMR) of 2-Ethylpyridine

Physical sample testing spectrum (NMR) of 2-Ethylpyridine

Retrosynthesis analysis of 2-Ethylpyridine

  • Route#1

    Cas:10034-85-2
    Cas:103-74-2
    Cas:100-71-0
  • Route#2

    Cas:109-06-8
    Cas:100-71-0
  • Route#3

    Cas:109-06-8
    Cas:67-56-1
    Cas:100-71-0