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328014

3-Methylhippuric acid

Name: 3-Methylhippuric acid
Brand: ALDRICH

98%

Synonym(s):

N-(3-Methylbenzoyl)glycine, m-Toluric acid

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About This Item

Linear Formula:

CH₃C₆H₄CONHCH₂CO₂H

CAS Number:

27115-49-7

Molecular Weight:

193.20

NACRES:

NA.22

PubChem Substance ID:

24859707

UNSPSC Code:

12352100

MDL number:

MFCD00044399

Assay:

98%

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Properties

Quality Segment

100

assay

98%

mp

138-140 °C (lit.)

functional group

amide, carboxylic acid

SMILES string

Cc1cccc(c1)C(=O)NCC(O)=O

InChI

1S/C10H11NO3/c1-7-3-2-4-8(5-7)10(14)11-6-9(12)13/h2-5H,6H2,1H3,(H,11,14)(H,12,13)

InChI key

YKAKNMHEIJUKEX-UHFFFAOYSA-N

Description

General description

3-Methylhippuric acid is also referred as m-methyl-hippuric acid. It is major product of xylene biotransformation in urine.

Application

3-Methylhippuric acid was employed as biological marker in studies on occupational exposure to xylene (solvent).

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Gloves, type N95 (US)

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