structure of 4-Aminopyridine-2-carboxylic acid

4-Aminopyridine-2-carboxylic acid

CAS No.: 100047-36-7
M. Wt: 138.124
M. Fa: C6H6N2O2
InChI Key: JRZBTJVSAANBEV-UHFFFAOYSA-N
Appearance: Pale-yellow Solid

Names and Identifiers of 4-Aminopyridine-2-carboxylic acid

CAS Number

100047-36-7

EC Number

687-925-9

MDL Number

MFCD02685671

IUPAC Name

4-aminopyridine-2-carboxylic acid

InChI

InChI=1S/C6H6N2O2/c7-4-1-2-8-5(3-4)6(9)10/h1-3H,(H2,7,8)(H,9,10)

InChIKey

JRZBTJVSAANBEV-UHFFFAOYSA-N

Canonical SMILES

C1=CN=C(C=C1N)C(=O)O

UNSPSC Code

12352100

Physical and chemical properties of 4-Aminopyridine-2-carboxylic acid

Acidity coefficient

1.37±0.50(Predicted)

Boiling Point

446.3±30.0 °C at 760 mmHg

Density

1.4±0.1 g/cm3

Exact Mass

138.042923

Flash Point

223.7±24.6 °C

Index of Refraction

1.649

LogP

-0.39

Melting Point

319°C

Molecular Formula

C6H6N2O2

Molecular Weight

138.124

PSA

76.21000

Solubility

Acetone, Ethanol, Methanol

Storage condition

under inert gas (nitrogen or Argon) at 2–8 °C

Vapour Pressure

0.0±1.1 mmHg at 25°C

Safety Information of 4-Aminopyridine-2-carboxylic acid

Pictograms

Signal Word

Warning

Safety Data Sheet

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

Applications of 4-Aminopyridine-2-carboxylic acid

4-Aminopyridine-2-carboxylic acid finds applications across various fields:

  • Pharmaceuticals: Due to its neuroprotective properties, it is investigated for potential use in treating neurological disorders.
  • Chemical Synthesis: It serves as a precursor for synthesizing more complex organic molecules, particularly in medicinal chemistry.
  • Research: Utilized in studies exploring ion channel modulation and neurotransmission enhancement.

Interaction Studies of 4-Aminopyridine-2-carboxylic acid

Studies on the interactions of 4-Aminopyridine-2-carboxylic acid have focused on its effects on ion channels, particularly potassium channels. Research indicates that it can block certain potassium channels, leading to increased neuronal excitability. This property has significant implications for its therapeutic potential in enhancing synaptic transmission and treating demyelinating diseases.

Biological Activity of 4-Aminopyridine-2-carboxylic acid

Research indicates that 4-Aminopyridine-2-carboxylic acid exhibits significant biological activity. It has been studied for its potential neuroprotective effects, particularly in the context of neurological disorders. The compound is known to enhance neurotransmitter release and improve synaptic transmission, making it a candidate for treating conditions like multiple sclerosis and spinal cord injuries. Additionally, it has shown promise in modulating potassium channels, which may lead to therapeutic applications in neurology.

Physical sample testing spectrum (NMR) of 4-Aminopyridine-2-carboxylic acid

Physical sample testing spectrum (NMR) of 4-Aminopyridine-2-carboxylic acid

Retrosynthesis analysis of 4-Aminopyridine-2-carboxylic acid

  • Route#1

    Cas:84487-16-1
    Cas:100047-36-7
  • Route#2

    Cas:18437-58-6
    Cas:100047-36-7
  • Route#3

    Cas:18085-47-7
    Cas:100047-36-7