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CAS Number: 78979-64-3
ethyl 2-(4-nitrophenyl)thiazole-4-carboxylate

Structure

ethyl 2-(4-nitrophenyl)thiazole-4-carboxylate
Name: ethyl 2-(4-nitrophenyl)thiazole-4-carboxylate
Synonyms:
General Information
Product Number: 78979643

CAS Registry Number 78979-64-3
Name:
4-​Thiazolecarboxylic acid, 2-​(4-​nitrophenyl)​-​, ethyl ester
Ethyl 2-(4-nitrophenyl)thiazole-4-carboxylate

 

Chemical Formula: C12H10N2O4S
Exact Mass: 278.04
Molecular Weight: 278.28
m/z: 278.04 (100.0%), 279.04 (14.0%), 280.03 (4.5%), 280.04 (1.8%)

 

InChI:InChI=1S/C12H10N2O4S/c1-2-18-12(15)10-7-19-11(13-10)8-3-5-9(6-4-8)14(16)17/h3-7H,2H2,1H3

InChI Key:XQBNPFPSRBLFHV-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C1=CSC(=N1)C2=CC=C(C=C2)[N+](=O)[O-]

 

Thermal Properties Value Condition Note
Melting Point 158-159 °C   (2)CAS
Melting Point 143-144 °C   (3)CAS
Melting Point 98-99 °C Solv: ligroine (8032-32-4) (5)IC
Melting Point See full text   (6)CAS

Specification

98%

References
  1. (2) Huang, Yue; Tetrahedron Letters 2010, V51(13), P1751-1753 CAPLUS
  2. (3) Wang, Yiyun; Tetrahedron 2011, V67(38), P7406-7411 CAPLUS
  3. (5) Badr, Mahmoud Zarif Amin; Bulletin of the Chemical Society of Japan 1981, V54(6), P1844-7 CAPLUS
  4. (6) Chabrier De Lassauniere, Pierre Etienne; US 20030078420 A1 2003 CAPLUS
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