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Methyl 2-(4,6-dichloropyriMidin-5-yl)acetate

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Methyl 2-(4,6-dichloropyriMidin-5-yl)acetate Basic information

Product Name:
Methyl 2-(4,6-dichloropyriMidin-5-yl)acetate
Synonyms:
  • Methyl 2-(4,6-dichloropyriMidin-5-yl)acetate
  • Methyl 4,6-Dichloropyrimidine-5-acetate
  • 5-Pyrimidineacetic acid, 4,6-dichloro-, methyl ester
CAS:
171096-33-6
MF:
C7H6Cl2N2O2
MW:
221.04
Mol File:
171096-33-6.mol
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Methyl 2-(4,6-dichloropyriMidin-5-yl)acetate Chemical Properties

Boiling point:
305.9±37.0 °C(Predicted)
Density 
1.448±0.06 g/cm3(Predicted)
storage temp. 
under inert gas (nitrogen or Argon) at 2-8°C
pka
-4.41±0.50(Predicted)
Appearance
White to off-white Solid
InChI
InChI=1S/C7H6Cl2N2O2/c1-13-5(12)2-4-6(8)10-3-11-7(4)9/h3H,2H2,1H3
InChIKey
ORHWGOUAAWDYFP-UHFFFAOYSA-N
SMILES
C1=NC(Cl)=C(CC(OC)=O)C(Cl)=N1
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Methyl 2-(4,6-dichloropyriMidin-5-yl)acetate Usage And Synthesis

Application

4,6-Dichloropyrimidine-5-acetic acid methyl ester is a pharmaceutical intermediate that can be prepared in three steps from diethyl malonate and ethyl bromoacetate as starting materials. It can be used in laboratory research and development processes as well as in chemical production processes.

Synthesis

Methyl 2-(4,6-dichloropyriMidin-5-yl)acetate can be produced through the Fischer esterification of the corresponding carboxylic acid, 2-(4,6-dichloropyrimidin-5-yl)acetic acid.

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