CAS:161798-03-4 / ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate--Hangzhou Chempro Technology Co., Ltd.

CAS Number: 161798-03-4
ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate

Structure
Name: ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate
Synonyms:

General Information

Product Number: 161798034

CAS Registry Number: 161798-03-4

Name:

5-Thiazolecarboxylic acid, 2-[3-formyl-4-(2-methylpropoxy)phenyl]-4-methyl-, ethyl ester

Ethyl 2-(3-formyl-4-isobutoxyphenyl)-4-methylthiazole-5-carboxylate

Chemical Formula: C18H21NO4S

Exact Mass: 347.12

Molecular Weight: 347.43

m/z: 347.12 (100.0%), 348.12 (20.8%), 349.11 (4.5%), 349.13 (1.9%), 349.12 (1.1%)

Elemental Analysis: C, 62.23; H, 6.09; N, 4.03; O, 18.42; S, 9.23

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

Canonical SMILES : CCOC(=O)C1=C(N=C(S1)C2=CC(=C(C=C2)OCC(C)C)C=O)C

Specification

98%

References

PCT Int. Appl. (2012), WO 2012168948 A2 20121213.

PCT Int. Appl. (2012), WO 2012131590 A1 20121004.

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