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CAS Number: 74476-53-2
ethyl 2-amino-4-(4-chlorophenyl)thiazole-5-carboxylate

Structure

ethyl 2-amino-4-(4-chlorophenyl)thiazole-5-carboxylate
Name: ethyl 2-amino-4-(4-chlorophenyl)thiazole-5-carboxylate
Synonyms:
General Information
Product Number: 74476532
CAS Registry Number: 74476-53-2
Name:
5-​Thiazolecarboxylic acid, 2-​amino-​4-​(4-​chlorophenyl)​-​, ethyl ester
 
Chemical Formula: C12H11ClN2O2S
Exact Mass: 282.02
Molecular Weight: 282.75
m/z: 282.02 (100.0%), 284.02 (36.6%), 283.03 (13.2%), 285.02 (5.3%), 286.02 (1.7%), 283.02 (1.5%), 284.03 (1.3%)
Elemental Analysis: C, 50.97; H, 3.92; Cl, 12.54; N, 9.91; O, 11.32; S, 11.34
 
InChI: InChI=1S/C12H11ClN2O2S/c1-2-17-11(16)10-9(15-12(14)18-10)7-3-5-8(13)6-4-7/h3-6H,2H2,1H3,(H2,14,15)
InChIKey: ZEOCGUADOVEENE-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=C(N=C(S1)N)C2=CC=C(C=C2)Cl
 
Thermal Properties Value Condition Note
Melting Point 198-200 °C   (2)IC

Specification

98%

References
  1. (1) Lethu, Sebastien; Journal of Medicinal Chemistry 2009, V52(20), P6205-6208 CAPLUS
  2. (2) Lee, Len F.; Journal of Heterocyclic Chemistry 1985, V22(6), P1621-30 CAPLUS
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