4-Bromo-2-fluorobenzenesulfonyl Chloride (CAS 216159-03-4)

4-Bromo-2-fluorobenzene-1-sulfonyl chloride

CAS 216159-03-4  ·  C6H3BrClFO2S  ·  MW 273.51 g/mol

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3D model 4-Bromo-2-fluorobenzene-1-sulfonyl chloride, CAS 216159-03-4, molecular formula C6H3BrClFO2S, molar mass 273.51 g/mol
About 4-Bromo-2-fluorobenzenesulfonyl Chloride (CAS 216159-03-4)

4-Bromo-2-fluorobenzenesulfonyl Chloride (CAS 216159-03-4) is a chemical compound registered under number CAS 216159-03-4, with the molecular formula C6H3BrClFO2S, and a molar mass of 273.51 g/mol.

The molecule contains 15 atoms connected by 15 chemical bonds. The full systematic IUPAC name of this compound is 4-bromo-2-fluorobenzenesulfonyl chloride. 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 = 2.7 (positive value, a lipophilic compound), polar surface area PSA = 42.5 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
Wzór sumarycznyC6H3BrClFO2S
Masa molowa273.51 g/mol
IUPAC4-bromo-2-fluorobenzenesulfonyl chloride
SMILESC1=CC(=C(C=C1Br)F)S(=O)(=O)Cl
InChIKeyXNYBZLRIUHNRQY-UHFFFAOYSA-N
logP (XLogP3)2.7
PSA42.5 Ų
HBD / HBA0 / 3
PubChem CIDCID 2736310 ↗
GHS safety

Sygnał: Niebezpieczeństwo

GHS05
GHS05

H314 — Powoduje poważne oparzenia skóry oraz uszkodzenia oczu

Scientific literature

Related literature

20 artykułów · 17 open access · Źródła: PubMed, OpenAlex, Semantic Scholar

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📈 Timeline publikacji (20 artykułów)

1967: 1 artykułów19671985: 1 artykułów1986: 1 artykułów19861992: 1 artykułów2026: 16 artykułów2026

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Dane z PubMed (NIH NLM), OpenAlex (CC0), Semantic Scholar (AI2). AI Summary wygenerowane przez Semantic Scholar TLDR. Artykuły z ikoną wymagają płatnego dostępu.

Synonyms
4-bromo-2-fluorobenzene-1-sulfonyl chloride · RefChem:519697 · 627-329-8 · 4-Bromo-2-fluorobenzenesulfonyl chloride · 216159-03-4 · 2-fluoro-4-bromobenzenesulfonyl chloride · MFCD01090993 · 4-bromo-2-fluoro-benzenesulfonyl Chloride · 4-bromo-2-fluorobenzenesulphonyl chloride · Benzenesulfonyl chloride, 4-bromo-2-fluoro- · (4-bromo-2-fluorophenyl)chlorosulfone · 4-Bromo-2-fluorobenzenesulfonylchloride · SCHEMBL121016 · SCHEMBL29467282 · XNYBZLRIUHNRQY-UHFFFAOYSA-N
Data sources
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