ChemicalBook--->CAS DataBase List--->850429-61-7

850429-61-7

850429-61-7 Structure

850429-61-7 Structure
IdentificationBack Directory
[Name]

METHYL 2-CHLORO-4-THIAZOLECARBOXYLATE
[CAS]

850429-61-7
[Synonyms]

METHYL 2-CHLOROTHIAZOLE-4-CARBOXYLATE
METHYL 2-CHLORO-4-THIAZOLECARBOXYLATE
Methyl 2-Chlorothiazole-5-Carboxylate
2-Chloro-4-(methoxycarbonyl)-1,3-thiazole
METHYL 2-CHLORO-1,3-THIAZOLE-4-CARBOXYLATE
Methyl2-chloro-1,3-thiazole-4-carboxylate95%
Methyl 2-chloro-1,3-thiazole-4-carboxylate 95%
4-Thiazolecarboxylic acid, 2-chloro-, methyl ester
[Molecular Formula]

C5H4ClNO2S
[MDL Number]

MFCD06659909
[MOL File]

850429-61-7.mol
[Molecular Weight]

177.61
Questions And AnswerBack Directory
[Synthesis]

METHYL 2-CHLORO-4-THIAZOLECARBOXYLATE was prepared from ethyl chloropyruvate and thiourea via a three-step process of cyclization, chlorination, and ester substitution. The synthetic route is shown in the figure below.

Synthesis of 850429-61-7

Figure 1 Synthetic route of METHYL 2-CHLORO-4-THIAZOLECARBOXYLATE

[Uses]

2-Chlorothiazole-4-carboxylic acid methyl ester is a carboxylic acid ester organic compound that can be used as a pharmaceutical intermediate.
Chemical PropertiesBack Directory
[Melting point ]

90-94
[Boiling point ]

271.2±32.0 °C(Predicted)
[density ]

1.456±0.06 g/cm3(Predicted)
[storage temp. ]

Inert atmosphere,2-8°C
[form ]

powder
[pka]

-1?+-.0.10(Predicted)
[color ]

Light tan (hint of brown)
[InChI]

InChI=1S/C5H4ClNO2S/c1-9-4(8)3-2-10-5(6)7-3/h2H,1H3
[InChIKey]

PZLJTHDJLAXFAW-UHFFFAOYSA-N
[SMILES]

S1C=C(C(OC)=O)N=C1Cl
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
[Hazard Note ]

Irritant
[HS Code ]

29349990
Raw materials And Preparation ProductsBack Directory
Spectrum DetailBack Directory
[Spectrum Detail]

METHYL 2-CHLORO-4-THIAZOLECARBOXYLATE(850429-61-7)1HNMR
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