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CAS Number: 100289-14-3
ethyl 5-acetyl-4-methylthiazole-2-carboxylate

Structure

ethyl 5-acetyl-4-methylthiazole-2-carboxylate
Name: ethyl 5-acetyl-4-methylthiazole-2-carboxylate
Synonyms:
General Information
Product Number: 100289143

CAS Registry Number 100289-14-3
Name:
2-​Thiazolecarboxylic acid, 5-​acetyl-​4-​methyl-​, ethyl ester

 

Chemical Formula: C9H11NO3S
Exact Mass: 213.05
Molecular Weight: 213.25
m/z: 213.05 (100.0%), 214.05 (10.8%), 215.04 (4.5%), 215.05 (1.2%)

 

InChI:InChI=1S/C9H11NO3S/c1-4-13-9(12)8-10-5(2)7(14-8)6(3)11/h4H2,1-3H3

InChI Key:BHIPQSKRMASYBP-UHFFFAOYSA-N

Canonical SMILES:CCOC(=O)C1=NC(=C(S1)C(=O)C)C

 

Thermal Properties Value Condition Note
Melting Point 33-35 °C   (1)CAS
Melting Point 33-35 °C Solv: ligroine (8032-32-4) (2)IC

Specification

98%

References
  1. (1) Milinkevich, Kristin A.; Journal of Combinatorial Chemistry 2008, V10(4), P521-525 CAPLUS
  2. (2) Oehler, Elisabeth; Chemische Berichte 1985, V118(10), P4099-130 CAPLUS
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