Methyl 5-bromopyridine-2-carboxylate

CAS 29682-15-3  ·  C7H6BrNO2  ·  MW 216.03 g/mol

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3D model Methyl 5-bromopyridine-2-carboxylate, CAS 29682-15-3, molecular formula C7H6BrNO2, molar mass 216.03 g/mol
About Methyl 5-bromopyridine-2-carboxylate

Methyl 5-bromopyridine-2-carboxylate is a chemical compound registered under number CAS 29682-15-3, with the molecular formula C7H6BrNO2, and a molar mass of 216.03 g/mol.

The molecule contains 17 atoms connected by 17 chemical bonds. The full systematic IUPAC name of this compound is methyl 5-bromopyridine-2-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 = 1.1 (positive value, a lipophilic compound), polar surface area PSA = 39.2 Ų, 0 donors and 3 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 formulaC7H6BrNO2
Masa molowa216.03 g/mol
IUPACmethyl 5-bromopyridine-2-carboxylate
SMILESCOC(=O)C1=NC=C(C=C1)Br
InChIKeyJEURNBCYNWNADN-UHFFFAOYSA-N
logP (XLogP3)1.1
PSA39.2 Ų
HBD / HBA0 / 3
PubChem CIDCID 7016458 ↗
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 · 9 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

📈 Publication timeline (15 articles)

1995: 1 articles19951999: 1 articles2014: 1 articles2015: 1 articles2016: 1 articles2018: 1 articles20182020: 1 articles2022: 1 articles2023: 2 articles2024: 1 articles2025: 3 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.

Data sources
Related molecules
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License & Provenance

MolGod 3D molecular model
Methyl 5-bromopyridine-2-carboxylate — CAS 29682-15-3

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

MolGod License & Provenance Record:
Methyl 5-bromopyridine-2-carboxylate (CAS 29682-15-3) — License & Provenance

Source:
Methyl 5-bromopyridine-2-carboxylate (CAS 29682-15-3) — MolGod molecule record

Source data: PubChem CID 7016458

STL: Download 3D model (345 KB)

SHA-256: 5bac0fc0303c7278b8f66dc2e7e99953ccb97b260e395dafdd3a38400feb6e27

Wikimedia Commons: not published yet

Source data: PubChem CID 7016458

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