1-Bromo-2-ethoxy-4-nitrobenzene

CAS 423165-33-7  ·  C8H8BrNO3  ·  MW 246.06 g/mol

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3D model 1-Bromo-2-ethoxy-4-nitrobenzene, CAS 423165-33-7, molecular formula C8H8BrNO3, molar mass 246.06 g/mol
About 1-Bromo-2-ethoxy-4-nitrobenzene

1-Bromo-2-ethoxy-4-nitrobenzene is a chemical compound registered under number CAS 423165-33-7, with the molecular formula C8H8BrNO3, and a molar mass of 246.06 g/mol.

The molecule contains 21 atoms connected by 21 chemical bonds. The full systematic IUPAC name of this compound is 1-bromo-2-ethoxy-4-nitrobenzene. 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 = 2.8 (positive value, a lipophilic compound), polar surface area PSA = 55.1 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 formulaC8H8BrNO3
Masa molowa246.06 g/mol
IUPAC1-bromo-2-ethoxy-4-nitrobenzene
SMILESCCOC1=C(C=CC(=C1)[N+](=O)[O-])Br
InChIKeyZALXYXWTUXLPBJ-UHFFFAOYSA-N
logP (XLogP3)2.8
PSA55.1 Ų
HBD / HBA0 / 3
PubChem CIDCID 22832075 ↗
GHS safety

Signal word: Warning

GHS07
GHS07

H302 — Działa szkodliwie po połknięciu

H315 — Działa drażniąco na skórę

H319 — Działa drażniąco na oczy

H335 — Może powodować podrażnienie dróg oddechowych

Scientific literature

Related literature

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

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

📈 Publication timeline (15 articles)

1933: 1 articles19331979: 1 articles1981: 1 articles1991: 1 articles19912011: 1 articles2022: 1 articles2022

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
1-BROMO-2-ETHOXY-4-NITROBENZENE · 423165-33-7 · RefChem:228387 · DTXCID10579333 · 2-Bromo-5-nitrophenetole · 2-Bromo-5-nitrophenyl ethyl ether · MFCD03790890 · SCHEMBL4074552 · CL8589 · AKOS015890200 · CS-W014120 · AB91652 · DS-10215 · 2-Bromo-4-nitrophenetole · SCHEMBL30962745
Data sources
Related molecules
📜 License & provenanceMolGod_License_1
1-Bromo-2-ethoxy-4-nitrobenzene (CAS 423165-33-7), C8H8BrNO3 - 3D ball-and-stick molecular model, engraved element symbols (C H Br N O), MolGod STL previewPobierz obraz

MG-STL-423165-33-7-GRAVERED · 109,536 △ · 5 MB · SHA-256 a609b59ab66d039d

Download 3D model · C H Br N O

1-Bromo-2-ethoxy-4-nitrobenzene (CAS 423165-33-7), C8H8BrNO3 - 3D ball-and-stick molecular model, MolGod STL previewPobierz obraz

MG-STL-423165-33-7-NORMAL · 8,736 △ · 427 KB · SHA-256 2f4a15b38cf404fc

Download 3D model

Model
1-Bromo-2-ethoxy-4-nitrobenzene · 423165-33-7
InChIKey
ZALXYXWTUXLPBJ-UHFFFAOYSA-N
License
CC BY-SA 4.0 International
Attribution
MolGod Scientific — 1-Bromo-2-ethoxy-4-nitrobenzene (CAS 423165-33-7)
License & provenance record
1-Bromo-2-ethoxy-4-nitrobenzene (CAS 423165-33-7) →
MolGod molecule record
1-Bromo-2-ethoxy-4-nitrobenzene →
Source data
PubChem CID 22832075 ↗
Model information
STL generated by MolGod · MolGod STL Exporter @ 8b6dfdd · generated 2026-09-26
SHA-256 (STL)
2f4a15b38cf404fc52bc2d4f01795ebb13208b125419187e9c7a35f486537d5c
MD5 (STL)
34433d25f3f7a368e42fa4ac3fafcf47
Model identifier
MG-STL-423165-33-7
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.

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