structure of 7-Methyl-1H-indazole-3-carboxylic acid

7-Methyl-1H-indazole-3-carboxylic acid

CAS No.: 1000340-53-3
M. Wt: 176.172
M. Fa: C9H8N2O2
InChI Key: BRQJRWNBYGCLDU-UHFFFAOYSA-N

Names and Identifiers of 7-Methyl-1H-indazole-3-carboxylic acid

CAS Number

1000340-53-3

EC Number

884-740-7

MDL Number

MFCD07378884

IUPAC Name

7-methyl-2H-indazole-3-carboxylic acid

InChI

InChI=1S/C9H8N2O2/c1-5-3-2-4-6-7(5)10-11-8(6)9(12)13/h2-4H,1H3,(H,10,11)(H,12,13)

InChIKey

BRQJRWNBYGCLDU-UHFFFAOYSA-N

Canonical SMILES

CC1=CC=CC2=C(NN=C12)C(=O)O

UNSPSC Code

12352100

Physical and chemical properties of 7-Methyl-1H-indazole-3-carboxylic acid

Acidity coefficient

3.15±0.10(Predicted)

Boiling Point

443.3±25.0 °C at 760 mmHg

Density

1.4±0.1 g/cm3

Exact Mass

176.058578

Flash Point

221.9±23.2 °C

Index of Refraction

1.709

LogP

1.76

Molecular Formula

C9H8N2O2

Molecular Weight

176.172

PSA

65.98000

Vapour Pressure

0.0±1.1 mmHg at 25°C

Safety Information of 7-Methyl-1H-indazole-3-carboxylic acid

Pictograms

Signal Word

 Warning

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

Applications of 7-Methyl-1H-indazole-3-carboxylic acid

The applications of 7-Methyl-1H-indazole-3-carboxylic acid are diverse:

  • Pharmaceuticals: It serves as an intermediate in the synthesis of various pharmaceutical compounds, particularly those targeting neurological disorders.
  • Biochemical Research: Utilized in studies investigating enzyme inhibition and receptor interactions due to its biological activity.
  • Chemical Probes: Its derivatives are employed as chemical probes in biological assays to elucidate mechanisms of action in cellular systems .

Interaction Studies of 7-Methyl-1H-indazole-3-carboxylic acid

Studies on 7-Methyl-1H-indazole-3-carboxylic acid have focused on its interactions with various biological targets:

  • Enzyme Inhibition: Research has demonstrated that this compound can inhibit specific enzymes involved in inflammatory pathways, suggesting potential therapeutic applications in treating inflammatory diseases.
  • Receptor Binding: Investigations into its binding affinity with serotonin receptors indicate possible roles in modulating neurotransmitter systems, contributing to its neuroprotective properties .

Biological Activity of 7-Methyl-1H-indazole-3-carboxylic acid

Research indicates that 7-Methyl-1H-indazole-3-carboxylic acid exhibits various biological activities. It has been studied for its potential as an anti-inflammatory agent and has shown promise in inhibiting certain cancer cell lines. Additionally, derivatives of this compound have been explored for their neuroprotective effects, particularly in models of neurodegenerative diseases .