2-Bromo-5-methyl-1,3-thiazole

CAS 41731-23-1  ·  C4H4BrNS  ·  MW 178.05 g/mol

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3D model 2-Bromo-5-methyl-1,3-thiazole, CAS 41731-23-1, molecular formula C4H4BrNS, molar mass 178.05 g/mol
About 2-Bromo-5-methyl-1,3-thiazole

2-Bromo-5-methyl-1,3-thiazole is a chemical compound registered under number CAS 41731-23-1, with the molecular formula C4H4BrNS, and a molar mass of 178.05 g/mol.

The molecule contains 11 atoms connected by 11 chemical bonds. The full systematic IUPAC name of this compound is 2-bromo-5-methyl-1,3-thiazole. 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 = 2.4 (positive value, a lipophilic compound), polar surface area PSA = 41.1 Ų, 0 donors and 2 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 formulaC4H4BrNS
Masa molowa178.05 g/mol
IUPAC2-bromo-5-methyl-1,3-thiazole
SMILESCC1=CN=C(S1)Br
InChIKeyFJPZHYAYNAUKKA-UHFFFAOYSA-N
logP (XLogP3)2.4
PSA41.1 Ų
HBD / HBA0 / 2
PubChem CIDCID 21906106 ↗
GHS safety

Signal word: Danger

GHS07
GHS07

H302 — Działa szkodliwie po połknięciu

H315 — Działa drażniąco na skórę

H335 — Może powodować podrażnienie dróg oddechowych

Scientific literature

Related literature

15 articles · 7 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (15 articles)

1990: 1 articles19902002: 1 articles2003: 2 articles2010: 1 articles2012: 2 articles2018: 1 articles20182021: 2 articles2022: 1 articles2024: 2 articles2026: 1 articles2026

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
41731-23-1 · 2-bromo-5-methyl-1,3-thiazole · RefChem:466889 · DTXCID90570606 · 808-041-3 · 2-bromo-5-methylthiazole · 2-Bromo-5-methyl-thiazole · Thiazole, 2-bromo-5-methyl- · MFCD08460610 · CHEMBL5185825 · CS-W007316 · AB45716 · FS-2634 · AC-25232 · A6866
Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
2-Bromo-5-methyl-1,3-thiazole — CAS 41731-23-1

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

MolGod License & Provenance Record:
2-Bromo-5-methyl-1,3-thiazole (CAS 41731-23-1) — License & Provenance

Source:
2-Bromo-5-methyl-1,3-thiazole (CAS 41731-23-1) — MolGod molecule record

Source data: PubChem CID 21906106

STL: Download 3D model (224 KB)

SHA-256: 14ccbb463ad5d628f972c118e0d6b9d2fd76d627f89cd0e6b3555f99d1716811

Wikimedia Commons: not published yet

Source data: PubChem CID 21906106

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