2-Hydroxy-2-phenylacetic acid isopropyl ester

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2-Hydroxy-2-phenylacetic acid isopropyl ester Basic information
Product Name:2-Hydroxy-2-phenylacetic acid isopropyl ester
Synonyms:2-Hydroxy-2-phenylacetic acid isopropyl ester;Hydroxy(phenyl)acetic acid isopropyl ester;Hydroxyphenylacetic acid isopropyl ester;Mandelic acid isopropyl;α-Hydroxybenzeneacetic acid isopropyl ester;Mandelic Acid Isopropyl Ester;Mandelic Acid Isopropyl Ester (Pregabalin EP Impurity D);Pregabalin Impurity D(EP)
CAS:4118-51-8
MF:C11H14O3
MW:194.23
EINECS:
Product Categories:
Mol File:4118-51-8.mol
2-Hydroxy-2-phenylacetic acid isopropyl ester Structure
2-Hydroxy-2-phenylacetic acid isopropyl ester Chemical Properties
Boiling point 249.15°C (rough estimate)
density 1.0312 (rough estimate)
refractive index 1.5600 (estimate)
storage temp. 2-8°C
pka12.39±0.20(Predicted)
Major Applicationpharmaceutical (small molecule)
InChI1S/C11H14O3/c1-8(2)14-11(13)10(12)9-6-4-3-5-7-9/h3-8,10,12H,1-2H3
InChIKeySCJJMBMUZTUIJU-UHFFFAOYSA-N
SMILESO(C(C)C)C(=O)C(O)c1ccccc1
LogP1.780 (est)
Safety Information
WGK Germany WGK 3
Storage Class11 - Combustible Solids
Hazard ClassificationsEye Irrit. 2
MSDS Information
2-Hydroxy-2-phenylacetic acid isopropyl ester Usage And Synthesis
UsesIsopropyl DL-Mandelate is used in nonporous silica/alumina amorphous material. Pregabalin (P704800) impurity.
2-Hydroxy-2-phenylacetic acid isopropyl ester Preparation Products And Raw materials
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