2-Chloro-5-(trifluoromethyl)benzeneboronic acid (CAS 182344-18-9)

2-Chloro-5-(trifluoromethyl)benzeneboronic acid (CAS 182344-18-9) is a chemical compound registered under number CAS 182344-18-9, with the molecular formula C₇H₅BClF₃O₂, and a molar mass of 224.37 g/mol.

The molecule contains 19 atoms connected by 19 chemical bonds. The full systematic IUPAC name of this compound is [2-chloro-5-(trifluoromethyl)phenyl]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 5 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.

Wzór sumaryczny	C7H5BClF3O2
Masa molowa	224.37 g/mol
IUPAC	[2-chloro-5-(trifluoromethyl)phenyl]boronic acid
SMILES	B(C1=C(C=CC(=C1)C(F)(F)F)Cl)(O)O
InChIKey	YVMXEHZEYONARR-UHFFFAOYSA-N
logP (XLogP3)	—
PSA	40.5 Ų
HBD / HBA	2 / 5
PubChem CID	CID 2782670 ↗

Sygnał: Uwaga

H315 — Działa drażniąco na skórę

H319 — Działa drażniąco na oczy

H335 — Może powodować podrażnienie dróg oddechowych

182344-18-9 · 2-Chloro-5-(trifluoromethyl)phenylboronic acid · RefChem:258902 · DTXCID20333226 · 627-479-4 · 2-Chloro-5-(trifluoromethyl)benzeneboronic acid · [2-chloro-5-(trifluoromethyl)phenyl]boronic Acid · 2-chloro-5-trifluoromethylphenylboronic acid · MFCD00797335 · 2-Chloro-5-(trifluoromethyl)phenylboronic Acid (contains varying amounts of Anhydride) · 2-chloro-5-trifluoromethyl-phenylboronic acid · Boronic acid, B-[2-chloro-5-(trifluoromethyl)phenyl]- · BP-11444 · EN300-861999 · 2-chloro-5-(trifluoromethyl)phenyl boronic acid

• 📊 PubChem CID 2782670 — NIH
• 🔬 NIST WebBook — spektroskopia
• 🌐 Wikidata
• 💊 ChEMBL — bioaktywność

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