structure of 2-(3-Chloro-4-methylphenyl)acetic acid

2-(3-Chloro-4-methylphenyl)acetic acid

CAS No.: 1000515-63-8
M. Wt: 184.62000
M. Fa: C9H9ClO2
InChI Key: BHGQSYHHKWNLNZ-UHFFFAOYSA-N

Names and Identifiers of 2-(3-Chloro-4-methylphenyl)acetic acid

CAS Number

1000515-63-8

EC Number

816-517-7

MDL Number

MFCD09924904

IUPAC Name

2-(3-chloro-4-methylphenyl)acetic acid

InChI

InChI=1S/C9H9ClO2/c1-6-2-3-7(4-8(6)10)5-9(11)12/h2-4H,5H2,1H3,(H,11,12)

InChIKey

BHGQSYHHKWNLNZ-UHFFFAOYSA-N

Canonical SMILES

CC1=C(C=C(C=C1)CC(=O)O)Cl

UNSPSC Code

12352100

Physical and chemical properties of 2-(3-Chloro-4-methylphenyl)acetic acid

Exact Mass

184.02900

H Bond Acceptors

2

H Bond Donors

1

LogP

2.27550

Molecular Formula

C9H9ClO2

Molecular Weight

184.62000

PSA

37.30000

Safety Information of 2-(3-Chloro-4-methylphenyl)acetic acid

Pictograms

Signal Word

 Warning

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

Applications of 2-(3-Chloro-4-methylphenyl)acetic acid

2-(3-Chloro-4-methylphenyl)acetic acid has potential applications in various fields:

  • Pharmaceutical Industry: As a building block for drug synthesis, particularly in developing anti-inflammatory medications.
  • Chemical Research: Used as a versatile scaffold in organic synthesis to create more complex molecules.
  • Agricultural Chemistry: Potentially utilized in developing herbicides or pesticides due to its structural properties.