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248967

(R)-(−)-α-Methoxyphenylacetic acid

Name: (<I>R</I>)-(−)-α-Methoxyphenylacetic acid
Brand: ALDRICH

99%

Synonym(s):

O-Methyl-D-mandelic acid

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About This Item

Linear Formula:

C₆H₅CH(OCH₃)CO₂H

CAS Number:

3966-32-3

Molecular Weight:

166.17

UNSPSC Code:

12352112

NACRES:

NA.22

PubChem Substance ID:

24854965

EC Number:

223-580-9

Beilstein/REAXYS Number:

2209198

MDL number:

MFCD00004250

Assay:

99%

Form:

solid

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Properties

Quality Level

100

assay

99%

form

solid

optical activity

[α]20/D −146°, c = 0.5 in ethanol

mp

66-68 °C (lit.)

functional group

carboxylic acid, ether, phenyl

SMILES string

CO[C@@H](C(O)=O)c1ccccc1

InChI

1S/C9H10O3/c1-12-8(9(10)11)7-5-3-2-4-6-7/h2-6,8H,1H3,(H,10,11)/t8-/m1/s1

InChI key

DIWVBIXQCNRCFE-MRVPVSSYSA-N

Description

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pictograms

GHS07

signalword

Warning

hcodes

H315,H319,H335

pcodes

P261 - P264 - P271 - P280 - P302 + P352 - P305 + P351 + P338

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Regulatory Information

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Discovery of inhibitors of the mitotic kinase TTK based on N-(3-(3-sulfamoylphenyl)-1H-indazol-5-yl)-acetamides and carboxamides.

Radoslaw Laufer et al.

Bioorganic & medicinal chemistry, 22(17), 4968-4997 (2014-07-22)

TTK kinase was identified by in-house siRNA screen and pursued as a tractable, novel target for cancer treatment. A screening campaign and systematic optimization, supported by computer modeling led to an indazole core with key sulfamoylphenyl and acetamido moieties at

Global Trade Item Number

SKU	GTIN
248967-1G	04061825928449