Methyl 2-bromobenzoate

CAS 610-94-6  ·  C8H7BrO2  ·  MW 215.04 g/mol

Loading molecule...
3D model Methyl 2-bromobenzoate, CAS 610-94-6, molecular formula C8H7BrO2, molar mass 215.04 g/mol
About Methyl 2-bromobenzoate

Methyl 2-bromobenzoate is a chemical compound registered under number CAS 610-94-6, with the molecular formula C8H7BrO2, and a molar mass of 215.04 g/mol.

The molecule contains 18 atoms connected by 18 chemical bonds. The full systematic IUPAC name of this compound is methyl 2-bromobenzoate. 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 = 26.3 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 formulaC8H7BrO2
Masa molowa215.04 g/mol
IUPACmethyl 2-bromobenzoate
SMILESCOC(=O)C1=CC=CC=C1Br
InChIKeySWGQITQOBPXVRC-UHFFFAOYSA-N
logP (XLogP3)2.4
PSA26.3 Ų
HBD / HBA0 / 2
PubChem CIDCID 11894 ↗
Scientific literature

Related literature

1 articles · 0 open access · Sources: PubMed, OpenAlex, Semantic Scholar

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

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
📜 License & provenanceMolGod_License_1
Methyl 2-bromobenzoate (CAS 610-94-6), C8H7BrO2 - 3D ball-and-stick molecular model, engraved element symbols (C H Br O), MolGod STL previewPobierz obraz

MG-STL-610-94-6-GRAVERED · 256,696 △ · 12 MB · SHA-256 2f8fbea3e4b60195

Download 3D model · C H Br O

Methyl 2-bromobenzoate (CAS 610-94-6), C8H7BrO2 - 3D ball-and-stick molecular model, MolGod STL previewPobierz obraz

MG-STL-610-94-6-NORMAL · 7,488 △ · 366 KB · SHA-256 1ab53c4fbebf80d8

Download 3D model

Model
Methyl 2-bromobenzoate · 610-94-6
InChIKey
SWGQITQOBPXVRC-UHFFFAOYSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — Methyl 2-bromobenzoate (CAS 610-94-6)
License & provenance record
Methyl 2-bromobenzoate (CAS 610-94-6) →
MolGod molecule record
Methyl 2-bromobenzoate →
Source data
PubChem CID 11894 ↗
Model information
STL generated by MolGod · MolGod STL Exporter @ 8b6dfdd · generated 2026-09-26
SHA-256 (STL)
1ab53c4fbebf80d891ec875b11801cd74b24db03b96a3fd6261dd7757c818175
MD5 (STL)
de9a18d57ecc9309d4e8c4a614c97e4b
Model identifier
MG-STL-610-94-6
Transformation
MolGod Scientific ball-and-stick mesh
Changes
Converted into a triangulated molecular mesh; atomic coordinates and connectivity unchanged.
Wikimedia Commons
not published yet

This license applies to the MolGod-created STL mesh, not automatically to third-party source material.

—