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Home > Encyclopedia > Ethyl4-Cyclopropyl-1,3-thiazole-2-carboxylate

Ethyl4-Cyclopropyl-1,3-thiazole-2-carboxylate

Ethyl4-Cyclopropyl-1,3-thiazole-2-carboxylate structure

Ethyl4-Cyclopropyl-1,3-thiazole-2-carboxylate 

structure
  • CAS No:

    439692-05-4

  • Formula:

    C9H11NO2S

  • Chemical Name:

    Ethyl4-Cyclopropyl-1,3-thiazole-2-carboxylate

  • Synonyms:

    Ethyl 4-cyclopropylthiazole-2-carboxylate;ETHYL 4-CYCLOPROPYL-1,3-THIAZOLE-2-CARBOXYLATE;MFCD11656780;SCHEMBL577947;2-BUTENYLMAGNESIUMCHLORIDE;CTK4I7901;KS-00000BDI;DTXSID10693907;6773AJ;ZINC42684232

Ethyl4-Cyclopropyl-1,3-thiazole-2-carboxylate Basic Attributes

197.257

197.05100

DTXSID10693907

2934100090

Characteristics

67.4

2.1

1.276g/cm3

301.5±35.0°C at 760 mmHg

136.1ºC

1.576

Ethyl4-Cyclopropyl-1,3-thiazole-2-carboxylate Use and Manufacturing

A solution of 2-bromo-1-cyclopropyl-ethanone (intermediate 12) (6.80 g, 42.0 mmol) and amino-thioxo-acetic acid ethyl ester (intermediate 6) (4.66 g, 35.0 mmol) in ethanol (50 mL) was heated to reflux for 1 hour. The reaction mixture was concentrated to dryness. The residue was purified by the flash column chromatography (silica, hexanes/ethyl acetate=4:1) to afford the title compound (6.7 g, 98percent).MS calcd for (CA solution of 2-bromo-1-cyclopropyl-ethanone (intermediate 12) (6.80 g, 42.0 mmol) and amino-thioxo-acetic acid ethyl ester (intermediate 6) (4.66 g, 35.0 mmol) in ethanol (50 mL) was heated to reflux for 1 hour. The reaction mixture was concentrated to dryness. The residue was purified by the flash column chromatography (silica, hexanes/ethyl acetate=4:1) to afford the title compound (6.7 g, 98percent).MS calcd for (C

Computed Properties

Molecular Weight:197.26
XLogP3:2.1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:197.05104977
Monoisotopic Mass:197.05104977
Topological Polar Surface Area:67.4
Heavy Atom Count:13
Complexity:206
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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