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CAS Number: 14527-43-6
ethyl thiazole-4-carboxylate

Structure

 ethyl thiazole-4-carboxylate
Name: ethyl thiazole-4-carboxylate
Synonyms:
General Information
Product Number: 14527436
CAS Registry Number: 14527-43-6
Name:
        4-​Thiazolecarboxylic acid, ethyl ester
        4-​Ethoxycarbonylthiazo​le; Ethyl 4-​thiazolecarboxylate 
 
Chemical Formula: C6H7NO2S
Exact Mass: 157.02
Molecular Weight: 157.19
m/z: 157.02 (100.0%), 158.02 (7.7%), 159.02 (5.0%)
Elemental Analysis: C, 45.85; H, 4.49; N, 8.91; O, 20.36; S, 20.40
 
InChI: InChI=1S/C6H7NO2S/c1-2-9-6(8)5-3-10-4-7-5/h3-4H,2H2,1H3
InChIKey: XDOKFEJMEJKVGX-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=CSC=N1
 
Thermal Properties Value Condition Note
Boiling Point 142-145 °C Press: 18 Torr (1)CAS
Boiling Point 130-131 °C Press: 12 Torr (2)CAS
Boiling Point 80 °C Press: 0.05 Torr (3)IC
Melting Point 57 °C   (2)CAS
Melting Point 57 °C   (1)CAS

Specification

98%
References
  1. (1) Erne, Max; Helvetica Chimica Acta 1951, V34, P143-8 CAPLUS
  2. (2) Erlenmeyer, H.; Helvetica Chimica Acta 1945, V28, P362-5 CAPLUS
  3. (3) Schoellkopf, Ulrich; Liebigs Annalen der Chemie 1979, (9), P1444-6 CAPLUS
  4. (4) Aulakh, Virender S.; Journal of Organic Chemistry 2009, V74(15), P5750-5753 CAPLUS
  5. (5) WSS: Spectral data were obtained from Wiley Subscription Services, Inc. (US)
  6. (6) Hartman, George D.; Synthesis 1976, (10), P681-2 CAPLUS
  7. (7) D'Amico, John J.; Journal of Organic Chemistry 1960, V25, P1336-42 CAPLUS
  8. (8) Zhelyazkov, L.; Trudove na Nauchnoizsledovatelskiya Khimikofarmatsevtichen Institut 1974, V9, P59-67 CAPLUS
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