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113366-46-4

113366-46-4 Structure

113366-46-4 Structure
IdentificationBack Directory
[Name]

2-ETHYL-4-METHYL THIAZOLE-5-CARBOXYLIC ACID
[CAS]

113366-46-4
[Synonyms]

2-ETHYL-4-METHYL THIAZOLE-5-CARBOXYLIC ACID
5-Thiazolecarboxylicacid, 2-ethyl-4-methyl-
2-ethyl-4-methyl-1,3-thiazole-5-carboxylic acid
2-ethyl-4-methyl-1,3-thiazole-5-carboxylic acid(SALTDATA: FREE)
[Molecular Formula]

C7H9NO2S
[MDL Number]

MFCD08458316
[MOL File]

113366-46-4.mol
[Molecular Weight]

171.22
Chemical PropertiesBack Directory
[Boiling point ]

313.5±22.0 °C(Predicted)
[density ]

1.280±0.06 g/cm3(Predicted)
[form ]

solid
[pka]

1.42±0.37(Predicted)
[InChI]

1S/C7H9NO2S/c1-3-5-8-4(2)6(11-5)7(9)10/h3H2,1-2H3,(H,9,10)
[InChIKey]

RIJXYOPYBANALA-UHFFFAOYSA-N
[SMILES]

O=C(O)C1=C(C)N=C(CC)S1
Safety DataBack Directory
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Synthesis Reference(s)]

Tetrahedron Letters, 28, p. 3585, 1987 DOI: 10.1016/S0040-4039(00)95542-4
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