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1-(1-methyl-1H-pyrazol-4-yl)ethanone
Weight124.143 g/mol
FormulaC6H8N2O
Hydrogen Acceptors3
Hydrogen Donors0
Aromatic Rings1
Rotatable Bonds1

1-(1-methyl-1H-pyrazol-4-yl)ethanone (37687-18-6)

37687-18-6

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Alternate Names

  • 37687-18-6
  • SMILES
    CC(=O)C1=CN(N=C1)C
  • InChIKey
    PINVCRAZGLSROU-UHFFFAOYSA-N

Estimated Properties

Boiling Point 210.41 C EPA T.E.S.T.
Boiling Point 203.19 C EPI Suite
Density 1.11 g/cm3 EPA T.E.S.T.
Flash Point 89.32 C EPA T.E.S.T.
Melting Point 26.34 C EPI Suite
Water Solubility 37299.8 mg/L EPA T.E.S.T.
Water Solubility 348570 mg/L EPI Suite

External Links

Synthesis

1-Methylpyrazole  +  ACETYL CHLORIDE (Friedel-Crafts acylation)
1-(1-Methylpyrazol-4-yl)ethanol  +  dimethyl sulfide (Corey-Kim oxidation of secondary alcohols)
Synthesis of 1-(1-methyl-1H-pyrazol-4-yl)ethanone ›

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689251-97-6 (689251-97-6)
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1,4-Dimethyl-1H-pyrazol-5-amine (3524-49-0)
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