Bromadiolone (CAS 28772-56-7)

Bromadiolone

CAS 28772-56-7  ·  C30H23BrO4  ·  MW 527.4 g/mol

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3D model Bromadiolone, CAS 28772-56-7, molecular formula C30H23BrO4, molar mass 527.4 g/mol
About Bromadiolone (CAS 28772-56-7)

Bromadiolone (CAS 28772-56-7) is a chemical compound registered under number CAS 28772-56-7, with the molecular formula C30H23BrO4, and a molar mass of 527.4 g/mol.

The molecule contains 58 atoms connected by 62 chemical bonds. The full systematic IUPAC name of this compound is 3-[3-[4-(4-bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-hydroxychromen-2-one. 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 = 6.1 (positive value, a lipophilic compound), polar surface area PSA = 66.8 Ų, 2 donors and 4 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 formulaC30H23BrO4
Masa molowa527.4 g/mol
IUPAC3-[3-[4-(4-bromophenyl)phenyl]-3-hydroxy-1-phenylpropyl]-4-hydroxychromen-2-one
SMILESC1=CC=C(C=C1)C(CC(C2=CC=C(C=C2)C3=CC=C(C=C3)Br)O)C4=C(C5=CC=CC=C5OC4=O)O
InChIKeyOWNRRUFOJXFKCU-UHFFFAOYSA-N
logP (XLogP3)6.1
PSA66.8 Ų
HBD / HBA2 / 4
PubChem CIDCID 54680085 ↗
GHS safety

Signal word: Danger

GHS06
GHS06
GHS08
GHS08
GHS09
GHS09

? — H360D

H330 — Wdychanie grozi śmiercią

H310 — Grozi śmiercią w kontakcie ze skórą

H300 — Połknięcie grozi śmiercią

H372 — Powoduje uszkodzenie narządów poprzez długotrwałe lub powtarzane narażenie

H400 — Działa bardzo toksycznie na organizmy wodne

H410 — Działa bardzo toksycznie na organizmy wodne, powodując długotrwałe skutki

Scientific literature

Related literature

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

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

📈 Publication timeline (8 articles)

1992: 1 articles19922005: 1 articles2006: 1 articles2010: 1 articles20102012: 1 articles2024: 2 articles2025: 1 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
Bromadiolone · 28772-56-7 · Broprodifacoum · Bromatrol · Super-rozol · Contrac · Ratimus · Boldo · Temus · Sup'operats · Boot hill · Topidion · Bromore · Contrax · Eradic
Data sources
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📜 License & provenanceMolGod_License_1
Model
Bromadiolone · 28772-56-7
License
CC BY 4.0 International (source rights undetermined — not yet granted)
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MolGod Scientific
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MolGod molecule record
Bromadiolone →
Source data
PubChem CID 54680085 ↗
SHA-256 (STL)
245e761b48d105f935099559ac0f0653022eb4543b7e38b1ea302353060a20fd
Wikimedia Commons
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