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CAS Number: 77505-83-0
ethyl 2-amino-5-isopropylthiazole-4-carboxylate

Structure

ethyl 2-amino-5-isopropylthiazole-4-carboxylate
Name: ethyl 2-amino-5-isopropylthiazole-4-carboxylate
Synonyms:
General Information
Product Number: 77505830
CAS Registry Number: 77505-83-0
Name:
4-​Thiazolecarboxylic acid, 2-​amino-​5-​(1-​methylethyl)​-​, ethyl ester
2-​Amino-​5-​isopropylthiazole-​4-​carboxylic acid ethyl ester 
 
Chemical Formula: C9H14N2O2S
Exact Mass: 214.08
Molecular Weight: 214.28
m/z: 214.08 (100.0%), 215.08 (10.8%), 216.07 (4.5%)
Elemental Analysis: C, 50.45; H, 6.59; N, 13.07; O, 14.93; S, 14.96
 
InChI: InChI=1S/C9H14N2O2S/c1-4-13-8(12)6-7(5(2)3)14-9(10)11-6/h5H,4H2,1-3H3,(H2,10,11)
InChIKey: UONWSWFRDMODNB-UHFFFAOYSA-N
Canonical SMILES : CCOC(=O)C1=C(SC(=N1)N)C(C)C
 
Thermal Properties Value Condition Note
Melting Point 122-123 °C Solv: ethanol (64-17-5); water (7732-18-5) (2)IC
Melting Point 120-122 °C Solv: benzene (71-43-2) (1)IC

Specification

98%

References
  1. (1) Manolova, P.; Farmatsiya (Sofia, Bulgaria) 1980, V30(4), P9-14 CAPLUS
  2. (2) 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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