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CAS Number: 81569-35-9
methyl 2-bromo-4-(tert-butyl)thiazole-5-carboxylate

Structure

 methyl 2-bromo-4-(tert-butyl)thiazole-5-carboxylate
Name: methyl 2-bromo-4-(tert-butyl)thiazole-5-carboxylate
Synonyms:
General Information
Product Number: 81569359

CAS Registry Number 81569-35-9
Name:
5-?Thiazolecarboxylic acid, 2-?bromo-?4-?(1,?1-?dimethylethyl)?-?, methyl este

 

Chemical Formula: C9H12BrNO2S
Exact Mass: 276.98
Molecular Weight: 278.17
m/z: 276.98 (100.0%), 278.98 (98.2%), 277.98 (10.7%), 279.98 (10.2%), 278.97 (4.5%), 280.97 (4.4%), 279.97 (1.2%)

 

InChI:InChI=1S/C9H12BrNO2S/c1-9(2,3)6-5(7(12)13-4)14-8(10)11-6/h1-4H3

InChI Key:NCGBNZLYWGDLFH-UHFFFAOYSA-N

Canonical SMILES:CC(C)(C)C1=C(SC(=N1)Br)C(=O)OC

 

Thermal Properties Value Condition Note
Melting Point 39-41 °C   (1)IC

Specification

98%
References
  1. (1) Barton, Anne; Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999) 1982, (1), P159-64 CAPLUS
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