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Merck
CN

248967

(R)-(−)-α-Methoxyphenylacetic acid

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

Key Documents

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InChI key

DIWVBIXQCNRCFE-MRVPVSSYSA-N

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

SMILES string

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

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

Quality Level

100

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pictograms

Exclamation mark
GHS07

signalword

Warning

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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Certificates of Analysis (COA)

Lot/Batch Number
BCCD7366
BCBN4202V
1451649V
1451648V
1451649

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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

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