structure of 2-(5-Methylpyridin-3-yl)acetic acid

2-(5-Methylpyridin-3-yl)acetic acid

CAS No.: 1000518-77-3
M. Wt: 151.16300
M. Fa: C8H9NO2
InChI Key: CNQAFBFTQKCRFV-UHFFFAOYSA-N
Appearance: Pale-Yellow To Yellow-Brown Solid

Names and Identifiers of 2-(5-Methylpyridin-3-yl)acetic acid

CAS Number

1000518-77-3

MDL Number

MFCD09925346

IUPAC Name

2-(5-methylpyridin-3-yl)acetic acid

InChI

InChI=1S/C8H9NO2/c1-6-2-7(3-8(10)11)5-9-4-6/h2,4-5H,3H2,1H3,(H,10,11)

InChIKey

CNQAFBFTQKCRFV-UHFFFAOYSA-N

Canonical SMILES

CC1=CC(=CN=C1)CC(=O)O

UNSPSC Code

12352100

Physical and chemical properties of 2-(5-Methylpyridin-3-yl)acetic acid

Exact Mass

151.06300

H Bond Acceptors

3

H Bond Donors

1

LogP

1.01710

Molecular Formula

C8H9NO2

Molecular Weight

151.16300

PSA

50.19000

Safety Information of 2-(5-Methylpyridin-3-yl)acetic acid

Pictograms

Signal Word

 Warning

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

Applications of 2-(5-Methylpyridin-3-yl)acetic acid

2-(5-Methylpyridin-3-yl)acetic acid finds applications in various fields:

  • Pharmaceuticals: It may serve as an intermediate in the synthesis of drugs targeting neurological disorders or inflammatory conditions.
  • Chemical Research: Used as a building block for developing new compounds with tailored properties.
  • Agricultural Chemistry: Potential applications in developing agrochemicals or plant growth regulators due to its biological activity.

Retrosynthesis analysis of 2-(5-Methylpyridin-3-yl)acetic acid

  • Route#1

    Cas:39891-12-8
    Cas:1000518-77-3