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2-(Pyrimidin-4-yl)malonaldehyde
Weight150.137 g/mol
FormulaC7H6N2O2
Hydrogen Acceptors4
Hydrogen Donors0
Aromatic Rings1
Rotatable Bonds3

2-(Pyrimidin-4-yl)malonaldehyde (28648-78-4)

28648-78-4  ·  4-pyrimidinylmalonaldehyde

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Alternate Names

  • 28648-78-4
  • 4-pyrimidinylmalonaldehyde
  • SMILES
    C1=CN=CN=C1C(C=O)C=O
  • InChIKey
    BQJUGEYYDDLNKB-UHFFFAOYSA-N

Estimated Properties

Boiling Point 222.63 C EPA T.E.S.T.
Boiling Point 271.52 C EPI Suite
Density 1.17 g/cm3 EPA T.E.S.T.
Flash Point 121.51 C EPA T.E.S.T.
Melting Point 67.16 C EPI Suite
Water Solubility 17722.7 mg/L EPA T.E.S.T.
Water Solubility 1e+06 mg/L EPI Suite

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Synthesis

PYRIMIDINE  +  2-CHLOROMALONALDEHYDE (Friedel-Crafts alkylation)
Reactant  +  dimethyl sulfide (Corey-Kim oxidation of secondary alcohols)
Synthesis of 2-(Pyrimidin-4-yl)malonaldehyde ›

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