Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methylthiazole-5-carboxylate , 98% , 161798-01-2

CAS NO.：161798-01-2

Empirical Formula: C14H13NO4S

Molecular Weight: 291.32

MDL number: MFCD13194810

EINECS: 692-179-2

PRODUCT Properties

• Melting point: 116 °C
• Boiling point: 446.7±55.0 °C(Predicted)
• Density: 1.335
• storage temp.: under inert gas (nitrogen or Argon) at 2-8°C
• solubility: DMSO (Slightly), Methanol (Slightly)
• form: Solid
• pka: 6.81±0.20(Predicted)
• color: Pale Yellow to Yellow
• InChI: InChI=1S/C14H13NO4S/c1-3-19-14(18)12-8(2)15-13(20-12)9-4-5-11(17)10(6-9)7-16/h4-7,17H,3H2,1-2H3
• InChIKey: NJRGQNNSIAFIJC-UHFFFAOYSA-N
• SMILES: S1C(C(OCC)=O)=C(C)N=C1C1=CC=C(O)C(C=O)=C1
• CAS DataBase Reference: 161798-01-2(CAS DataBase Reference)

Description and Uses

Ethyl 2-(3-formyl-4-hydroxyphenyl)-4-methyl thiazole-5-carboxylate is a pharmaceutical intermediate used in the preparation of the xanthine oxidase inhibitor febuxostat, which is used in the treatment of hyperuricaemia and gout. It is also used in the synthesis of novel thiazolyl α-aminophosphonates.

Ethyl 2-(3-Formyl-4-hydroxyphenyl)-4-methylthiazole-5-carboxylate is a product prepared via reaction 4-Hydroxybenzene-1-benzothiomide with ethyl-2-chloro acetoacetate. An antibacterial agent and antifungal activity against C.albicans.

Safety

• Symbol(GHS): GHS07
• Signal word: Warning
• Hazard statements: H319-H315-H335
• Precautionary statements: P264-P280-P305+P351+P338-P337+P313P-P264-P280-P302+P352-P321-P332+P313-P362
• HS Code: 2934100090