structure of 2-(3-(Trifluoromethyl)pyridin-2-yl)acetic acid

2-(3-(Trifluoromethyl)pyridin-2-yl)acetic acid

CAS No.: 1000521-27-6
M. Wt: 205.13400
M. Fa: C8H6F3NO2
InChI Key: CGXGLHGMLGPAQT-UHFFFAOYSA-N
Appearance: White Solid

Names and Identifiers of 1000521-27-6

CAS Number

1000521-27-6

MDL Number

MFCD09924925

IUPAC Name

2-[3-(trifluoromethyl)pyridin-2-yl]acetic acid

InChI

InChI=1S/C8H6F3NO2/c9-8(10,11)5-2-1-3-12-6(5)4-7(13)14/h1-3H,4H2,(H,13,14)

InChIKey

CGXGLHGMLGPAQT-UHFFFAOYSA-N

Canonical SMILES

C1=CC(=C(N=C1)CC(=O)O)C(F)(F)F

UNSPSC Code

12352100

Physical and chemical properties of 1000521-27-6

Exact Mass

205.03500

LogP

1.72750

Molecular Formula

C8H6F3NO2

Molecular Weight

205.13400

PSA

50.19000

Storage condition

Inert atmosphere,Store in freezer, under -20°C

Safety Information of 1000521-27-6

Pictograms

Signal Word

 Warning

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

Applications of 1000521-27-6

This compound has several applications, including:

  • Reagent in Organic Synthesis: It is used as a building block in the synthesis of more complex organic molecules.
  • Additive in Coatings: Due to its chemical stability and properties, it is utilized as an additive in protective bonding agents and coatings formulations.
  • Potential Pharmaceutical Intermediates: Its unique structure may serve as a precursor for developing new pharmaceutical agents.

Interaction Studies of 1000521-27-6

While specific interaction studies involving 2-(3-(Trifluoromethyl)pyridin-2-yl)acetic acid are scarce, its structural characteristics suggest that it could interact with various biological macromolecules. The trifluoromethyl group may enhance binding affinity to certain targets, making it a candidate for further pharmacological studies.