ChemicalBook >> CAS DataBase List >>ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE

ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE

CAS No.
161798-03-4
Chemical Name:
ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE
Synonyms
2-(3-forMyl;Febuxostat-24;-4-isobutoxyphenyL;Febuxostat Impurity G;Febuxostat Impurity 2;Febuxostat Impurities2;Febuxostat Impurity Z18;Febuxostat Impurity Z2-2;Ethyl 2-(3-formyl-4-isobutoxyphenyl);Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiaz
CBNumber:
CB11474517
Molecular Formula:
C18H21NO4S
Molecular Weight:
347.43
MDL Number:
MFCD13194811
MOL File:
161798-03-4.mol
MSDS File:
SDS
Last updated:2026-07-16 18:07:46
Product description Number Pack Size Price
Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate 448748 500mg $305
Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate 448748 1g $396
Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate 98%(HPLC) Y0387 1g $62
Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate 98%(HPLC) Y0387 5g $173
Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate 98%(HPLC) Y0387 10g $343
More product size

ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE Properties

Melting point 158-160°C
Boiling point 495.9±55.0 °C(Predicted)
Density 1.183
storage temp. under inert gas (nitrogen or Argon) at 2-8°C
solubility Chloroform (Slightly), Methanol (Slightly, Sonicated)
form Solid
pka 1.39±0.10(Predicted)
color Pale Yellow
InChI InChI=1S/C18H21NO4S/c1-5-22-18(21)16-12(4)19-17(24-16)13-6-7-15(14(8-13)9-20)23-10-11(2)3/h6-9,11H,5,10H2,1-4H3
InChIKey AIQMFFCWDAIGNV-UHFFFAOYSA-N
SMILES S1C(C(OCC)=O)=C(C)N=C1C1=CC=C(OCC(C)C)C(C=O)=C1
CAS DataBase Reference 161798-03-4(CAS DataBase Reference)

SAFETY

Risk and Safety Statements

Symbol(GHS)  Exclamation Mark (GHS07)
GHS07
Signal word  Warning
Hazard statements  H315-H319
Precautionary statements  P264-P280-P302+P352-P321-P332+P313-P362-P264-P280-P305+P351+P338-P337+P313P
REACH Registrations Active

ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE price More Price(50)

Manufacturer Product number Product description CAS number Packaging Price Updated Buy
Usbiological 448748 Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate 161798-03-4 500mg $305 2026-06-03 Buy
Usbiological 448748 Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate 161798-03-4 1g $396 2026-06-03 Buy
AK Scientific Y0387 Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate 98%(HPLC) 161798-03-4 1g $62 2026-06-04 Buy
AK Scientific Y0387 Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate 98%(HPLC) 161798-03-4 5g $173 2026-06-04 Buy
AK Scientific Y0387 Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate 98%(HPLC) 161798-03-4 10g $343 2026-06-04 Buy
Product number Packaging Price Buy
448748 500mg $305 Buy
448748 1g $396 Buy
Y0387 1g $62 Buy
Y0387 5g $173 Buy
Y0387 10g $343 Buy

ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE Chemical Properties,Uses,Production

Uses

Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate is an impurity of Febuxostat (F229000), which is a xanthine oxidase/xanthine dehydrogenase inhibitor, used for treatment of hyperuricemia and chronic gout.

Synthesis

Preparation of Compound of formula III)[0094] A compound of formula II (10.0 gr, 34.33 mmol) was reacted with iso- butyl bromide (18.9 gr, 137.3 mmol) in the presence of potassium carbonate (19.0 gr, 137.3 mmol) and potassium iodide (2.3 gr, 13.7 mmol) in 60 ml dimethylformamide. The reaction was performed at about 70°C during 4 hours. The reaction mixture was extracted at 70°C using 300 ml ethyl acetate and 600 ml water. The separated aqueous phase was washed twice with 100 ml ethyl acetate. The combined organic phase was washed twice with 100 ml water and then concentrated to dryness. The resulting solid residue was re- crystallized from 70 ml ethyl acetate, filtered and dried under reduced pressure at about 40°C to provide a compound of formula III (8.9 gr, yield - 83percent). The Compound of formula III purity is 99.1percent (by HPLC).

References

[1] Patent: WO2011/31409, 2011, A1. Location in patent: Page/Page column 15
[2] Patent: WO2011/141933, 2011, A2. Location in patent: Page/Page column 46
[3] Patent: WO2012/131590, 2012, A1. Location in patent: Page/Page column 15; 21; 23
[4] Patent: WO2012/168948, 2012, A2. Location in patent: Page/Page column 11
[5] Patent: WO2015/18507, 2015, A2. Location in patent: Page/Page column 12

ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE Preparation Products And Raw materials

Global( 342)Suppliers
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HEBEI BRANT PHARMACEUTICAL CO.,LTD
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+86-2158073036 info@dakenam.com China 14032 58
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View Lastest Price from ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE manufacturers

Image Update time Product Price Min. Order Purity Supply Ability Manufacturer
Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate pictures 2026-08-08 Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate
161798-03-4
1kg 99.0%min 5MT Hangzhou ICH Biofarm Co., Ltd
Febuxostat Impurity pictures 2026-08-07 Febuxostat Impurity
161798-03-4
1KG 99%min 1000kg WUHAN FORTUNA CHEMICAL CO., LTD
ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE pictures 2026-07-16 ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE
161798-03-4
1kg 98% 1000kgs Shaanxi Dideu New Materials Co. Ltd

ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE Spectrum

Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole- Ethyl-2-(3-Formyl-4-isobutoxy phenyl)-4-methyl-1,3-thiazole-5-carboxylate Febuxostat-24 2-(3-forMyl 5-Thiazolecarboxylicacid, 2-[3-forMyl-4-(2-Methylpropoxy)phenyl]-4-Methyl-, ethyl ester ethyl-2-[3-forMyl-4-(2-Methylpropoxy)phenyl]-4-Methyl-5-thiazolecarboxylate Febuxostat Impurity 2 Febuxostat Impurity G 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate Ethyl 2-(3-formyl-4-isobutoxyphenyl) ETHYL 2-(3-FORMYL-4-ISOBUTOXYPHENYL)-4-METHYLTHIAZOLE-5-CARBOXYLATE 2-(3-Formyl-4-isobutoxy-phenyl)-4-methyl-thiazole-5-carboxylic acid ethyl ester 5-carboxylato-1-ethyl-2-[3-forMyl-4-(2-Methylpropoxy)phenyl]-4-Methyl-1H-1$l^{4},3-thiazol-1-yl Febuxostat Impurity Z18 2-(3-forMyl-4-isobutoxyphenyI)-4-MethyIthiazole-5-carboxylic acid ethyl ester Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiaz 2-[3-formyl-4-(2-methylpropoxy)phenyl]-4-methyl-5-Thiazolecarboxylicacid ethyl ester -4-isobutoxyphenyL Febuxostat intermediates,Ethyl 2-(3-Formyl-4-isobutoxyphenyl)- 4-Methylthiazole-5-Carboxylate Ethyl 2-(3-cyano-4-hydroxyphenyl)-4-methyl-1,3-thiazole-5-carboxylate 2- Ethyl 2-(3-Formyl-4-isobutoxyphenyl)-4-Methylthiazole-5-Carb... Febuxostat Impurities2 2 - (3-aldehyde-4-isobutyloxyphenyl) - 4-methylthiazole-5-carboxylic acid ethyl ester Ethyl 2-(3- aldehyde -4- isobutyloxyphenyl) -4- methylthiazole -5- carboxylate 5-Thiazolecarboxylic acid, 2-[3-formyl-4-(2-methylpropoxy)phenyl]-4-methyl-, ethyl ester (9CI, ACI) 2-[3-formyl-4-(2-methylpropoxy)phenyl]-4-methyl-5-Thiazolecarboxylic acid ethyl ester (9CI ACI) Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate (F4) 2-(3-formyl-4-isobutoxyphenyl)-4-methyl-1,3-thiazole-5-carboxylat Febuxostat Impurity Z2-2 Febuxostat Impurity 2 ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5- carboxylate ethyl 2-[3-formyl-4-(2-methylpropoxy)phenyl]-4-methyl-1,3-thiazole-5-carboxylate 2-(3-Formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate 98%min Ethyl 2-(3-formyl-4-isobutoxy-phenyl)-4-methylthiazol-5-carboxylate 161798-03-4 84006-10-6 1161798-03-4 Febuxostat intermediate 161798-03-4