structure of 2-(6-Chloro-5-methylpyridin-3-yl)acetic acid

2-(6-Chloro-5-methylpyridin-3-yl)acetic acid

CAS No.: 1000546-06-4
M. Wt: 185.60800
M. Fa: C8H8ClNO2
InChI Key: BLMQSKNWZLCAEW-UHFFFAOYSA-N
Appearance: Pale-yellow Solid

Names and Identifiers of 1000546-06-4

CAS Number

1000546-06-4

MDL Number

MFCD09925187

IUPAC Name

2-(6-chloro-5-methylpyridin-3-yl)acetic acid

InChI

InChI=1S/C8H8ClNO2/c1-5-2-6(3-7(11)12)4-10-8(5)9/h2,4H,3H2,1H3,(H,11,12)

InChIKey

BLMQSKNWZLCAEW-UHFFFAOYSA-N

Canonical SMILES

CC1=CC(=CN=C1Cl)CC(=O)O

UNSPSC Code

12352100

Physical and chemical properties of 1000546-06-4

Exact Mass

185.02400

H Bond Acceptors

3

H Bond Donors

1

LogP

1.67050

Molecular Formula

C8H8ClNO2

Molecular Weight

185.60800

PSA

50.19000

Safety Information of 1000546-06-4

Pictograms

Signal Word

 Warning

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

Physical sample testing spectrum (NMR) of 1000546-06-4

Physical sample testing spectrum (NMR) of 1000546-06-4