3-Chloro-4-fluorophenylboronic acid (CAS 144432-85-9)

3-Chloro-4-fluorophenylboronic Acid (contains varying amounts of Anhydride)

CAS 144432-85-9  ·  C6H5BClFO2  ·  MW 174.37 g/mol

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3D model 3-Chloro-4-fluorophenylboronic Acid (contains varying amounts of Anhydride), CAS 144432-85-9, molecular formula C6H5BClFO2, molar mass 174.37 g/mol
About 3-Chloro-4-fluorophenylboronic acid (CAS 144432-85-9)

3-Chloro-4-fluorophenylboronic acid (CAS 144432-85-9) is a chemical compound registered under number CAS 144432-85-9, with the molecular formula C6H5BClFO2, and a molar mass of 174.37 g/mol.

The molecule contains 16 atoms connected by 16 chemical bonds. The full systematic IUPAC name of this compound is (3-chloro-4-fluorophenyl)boronic acid. 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, polar surface area PSA = 40.5 Ų, 2 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 sumarycznyC6H5BClFO2
Masa molowa174.37 g/mol
IUPAC(3-chloro-4-fluorophenyl)boronic acid
SMILESB(C1=CC(=C(C=C1)F)Cl)(O)O
InChIKeyWJDZZXIDQYKVDG-UHFFFAOYSA-N
logP (XLogP3)—
PSA40.5 Ų
HBD / HBA2 / 3
PubChem CIDCID 2734660 ↗
GHS safety

Sygnał: Uwaga

GHS07
GHS07

H315 — Działa drażniąco na skórę

H319 — Działa drażniąco na oczy

H335 — Może powodować podrażnienie dróg oddechowych

Scientific literature

Related literature

20 artykułów · 16 open access · Źródła: PubMed, OpenAlex, Semantic Scholar

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📈 Timeline publikacji (20 artykułów)

2016: 1 artykułów20162017: 1 artykułów2025: 2 artykułów20252026: 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
3-Chloro-4-fluorophenylboronic acid (contains varying amounts of Anhydride) · RefChem:499973 · 675-657-5 · 3-Chloro-4-fluorophenylboronic acid · 144432-85-9 · (3-chloro-4-fluorophenyl)boronic acid · 3-Chloro-4-fluorobenzeneboronic acid · MFCD00051800 · (3-chloro-4-fluoro-phenyl)boronic Acid · Boronic acid, B-(3-chloro-4-fluorophenyl)- · CHEMBL279024 · 4-fluoro-3-chlorophenylboronic acid · 3-Chloro-4-fluorophenyl boronic acid · B-(3-CHLORO-4-FLUOROPHENYL)-BORONIC ACID · 3-Chloro-4-fluorophenylboronicacid
Data sources
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