Ethyl 4-amino-2-(methylthio)-1,3-thiazole-5-carboxylate

CAS

39736-29-3

Catalog Number

ACM39736293

Category

Other Products

Molecular Weight

218.3

Molecular Formula

C₇H₁₀N₂O₂S₂

MSDS COA Spec Sheet

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Specification

Synonyms

TimTec1_001416, MLS000877944, NSC675697, MolPort-000-159-915, AIDS146896, HMS1538A08, AIDS-146896, CID384908, ZINC00043484, NCGC00174453-01, GK 00772, SMR000376909, AA-516/30012021, AI-067/31570045, SR-01000572726-2, Ethyl 4-amino-2-(methylthio)-1,3-thiazole-5-carboxylate, 4-amino-2-methylsulfanyl-thiazole-5-carboxylic acid ethyl ester, ethyl 4-amino-2-(methylsulfanyl)-1,3-thiazole-5-carboxylate, 39736-29-3

IUPAC Name

ethyl 4-amino-2-methylsulfanyl-1,3-thiazole-5-carboxylate

Canonical SMILES

CCOC(=O)C1=C(N=C(S1)SC)N

InChI Key

WAFDSQXKSGGKCD-UHFFFAOYSA-N

Boiling Point

368.6ºC at 760mmHg

Flash Point

176.7ºC

Density

1.37g/cm³

Exact Mass

218.01800

H-Bond Acceptor

H-Bond Donor

Upstream Synthesis Route 1

623-51-8
10191-60-3

39736-29-3

Reference: [1] Patent: US2013/72482, 2013, A1, . Location in patent: Paragraph 0315-0317

Upstream Synthesis Route 2

10191-61-4
105-36-2

39736-29-3

Reference: [1] Bioorganic and Medicinal Chemistry, 2016, vol. 24, # 22, p. 5911 - 5920
[2] Patent: WO2011/100838, 2011, A1, . Location in patent: Page/Page column 60; 61