structure of 2-(5-Fluoropyridin-2-YL)acetic acid

2-(5-Fluoropyridin-2-YL)acetic acid

CAS No.: 1000515-83-2
M. Wt: 155.126
M. Fa: C7H6FNO2
InChI Key: GNZVAIZIJBXHHD-UHFFFAOYSA-N
Appearance: yellow solid

Names and Identifiers of 2-(5-Fluoropyridin-2-YL)acetic acid

CAS Number

1000515-83-2

MDL Number

MFCD09924935

IUPAC Name

2-(5-fluoropyridin-2-yl)acetic acid

InChI

InChI=1S/C7H6FNO2/c8-5-1-2-6(9-4-5)3-7(10)11/h1-2,4H,3H2,(H,10,11)

InChIKey

GNZVAIZIJBXHHD-UHFFFAOYSA-N

Canonical SMILES

C1=CC(=NC=C1F)CC(=O)O

UNSPSC Code

12352100

Physical and chemical properties of 2-(5-Fluoropyridin-2-YL)acetic acid

Acidity coefficient

3.90±0.10(Predicted)

Boiling Point

265.0±25.0 °C at 760 mmHg

Density

1.4±0.1 g/cm3

Exact Mass

155.038254

Flash Point

114.1±23.2 °C

Index of Refraction

1.533

LogP

0.05

Molecular Formula

C7H6FNO2

Molecular Weight

155.126

PSA

50.19000

Vapour Pressure

0.0±0.6 mmHg at 25°C

Safety Information of 2-(5-Fluoropyridin-2-YL)acetic acid

Pictograms

Signal Word

 Warning

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

Biological Activity of 2-(5-Fluoropyridin-2-YL)acetic acid

2-(5-Fluoropyridin-2-YL)acetic acid has been studied for its potential biological activities. It has shown promise as an inhibitor of mPGES-1 (microsomal prostaglandin E synthase-1), which is a target in cancer and inflammation therapies. In vitro studies have indicated that compounds similar to this one can induce cell cycle arrest and apoptosis in cancer cell lines.

Physical sample testing spectrum (NMR) of 2-(5-Fluoropyridin-2-YL)acetic acid

Physical sample testing spectrum (NMR) of 2-(5-Fluoropyridin-2-YL)acetic acid