Ethyl 2-aminothiazole-4-carboxylate

CAS 5398-36-7  ·  C6H8N2O2S  ·  MW 172.21 g/mol

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3D model Ethyl 2-aminothiazole-4-carboxylate, CAS 5398-36-7, molecular formula C6H8N2O2S, molar mass 172.21 g/mol
About Ethyl 2-aminothiazole-4-carboxylate

Ethyl 2-aminothiazole-4-carboxylate is a chemical compound registered under number CAS 5398-36-7, with the molecular formula C6H8N2O2S, and a molar mass of 172.21 g/mol.

The molecule contains 19 atoms connected by 19 chemical bonds. The full systematic IUPAC name of this compound is ethyl 2-amino-1,3-thiazole-4-carboxylate. The interactive 3D model above lets you view the spatial arrangement of the atoms — you can rotate it with the mouse, zoom with the scroll wheel, and switch between skeletal / Ball & Stick / Space Fill visualization modes.

In terms of physicochemical properties, the partition coefficient logP = 1.2 (positive value, a lipophilic compound), polar surface area PSA = 93.5 Ų, 1 donors and 5 hydrogen bond acceptors. These parameters are key when assessing bioavailability and interaction with biomolecules.

Chemical data for this compound comes from PubChem (NIH NLM NCBI), one of the world's largest chemical databases. All information is updated automatically and enriched with GHS hazard statement translations compliant with the CLP Regulation (EC 1272/2008). The widget above may be used for educational, research and commercial purposes.

Physicochemical properties
Molecular formulaC6H8N2O2S
Masa molowa172.21 g/mol
IUPACethyl 2-amino-1,3-thiazole-4-carboxylate
SMILESCCOC(=O)C1=CSC(=N1)N
InChIKeyXHFUVBWCMLLKOZ-UHFFFAOYSA-N
logP (XLogP3)1.2
PSA93.5 Ų
HBD / HBA1 / 5
PubChem CIDCID 73216 ↗
GHS safety

Signal word: Warning

GHS07
GHS07

H315 — Działa drażniąco na skórę

H319 — Działa drażniąco na oczy

H335 — Może powodować podrażnienie dróg oddechowych

Scientific literature

Related literature

15 articles · 4 open access · Sources: PubMed, OpenAlex, Semantic Scholar

Filtry:Eksport:📄 BibTeX📑 RIS📋 EndNote🔧 CSL-JSON

📈 Publication timeline (15 articles)

1958: 1 articles19581989: 8 articles1999: 1 articles2000: 1 articles20002015: 1 articles2016: 1 articles2025: 2 articles2025

Bar height = number of articles per year. Hover dla szczegółów.

Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

Synonyms
Ethyl 2-aminothiazole-4-carboxylate · ethyl 2-amino-1,3-thiazole-4-carboxylate · RefChem:594217 · Ethyl 2amino4thiazolecarboxylate · Ethyl 2amino1,3thiazole4carboxylate · 4Thiazolecarboxylic acid, 2amino, ethyl ester · 611-074-4 · 5398-36-7 · Ethyl 2-amino-4-thiazolecarboxylate · 2-Amino-thiazole-4-carboxylic acid ethyl ester · MFCD00619079 · 4-Thiazolecarboxylic acid, 2-amino-, ethyl ester · 2-amino-4-ethoxycarbonylthiazole · 2-aminothiazole-4-carboxylic acid ethyl ester · NSC4464
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
Ethyl 2-aminothiazole-4-carboxylate — CAS 5398-36-7

License: CC BY-SA 4.0 (source rights NIEUSTALONE — not yet granted for this model)

MolGod License & Provenance Record:
Ethyl 2-aminothiazole-4-carboxylate (CAS 5398-36-7) — License & Provenance

Source:
Ethyl 2-aminothiazole-4-carboxylate (CAS 5398-36-7) — MolGod molecule record

Source data: PubChem CID 73216

STL: Download 3D model (386 KB)

SHA-256: 04b09cd020f85399a6100b4ddf5794694f2f469db8add48046dd5bef1c071409

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Source data: PubChem CID 73216

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