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2-chloro-N-(5-methyl-3-isoxazolyl)acetamide
Weight174.587 g/mol
FormulaC6H7ClN2O2
Hydrogen Acceptors3
Hydrogen Donors1
Aromatic Rings1
Rotatable Bonds2

2-chloro-N-(5-methyl-3-isoxazolyl)acetamide (59826-53-8)

59826-53-8

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Alternate Names

  • 59826-53-8
  • SMILES
    CC1=CC(=NO1)NC(=O)CCl
  • InChIKey
    DXJICGSIRAJIDN-UHFFFAOYSA-N

Estimated Properties

Boiling Point 247.98 C EPA T.E.S.T.
Boiling Point 333.44 C EPI Suite
Density 1.28 g/cm3 EPA T.E.S.T.
Flash Point 126.28 C EPA T.E.S.T.
Melting Point 118.36 C EPI Suite
Water Solubility 7822.99 mg/L EPA T.E.S.T.
Water Solubility 22941 mg/L EPI Suite

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Synthesis

CHLOROACETYL CHLORIDE  +  3-Amino-5-methylisoxazole (Schotten-Baumann amide from acid)
Reactant  +  dimethyl sulfide (Corey-Kim oxidation of secondary alcohols)
Synthesis of 2-chloro-N-(5-methyl-3-isoxazolyl)acetamide ›

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