Pentafluorobenzaldehyde

Pentafluorobenzaldehyde is a chemical compound registered under number CAS 653-37-2, with the molecular formula C₇HF₅O, and a molar mass of 196.07 g/mol.

The molecule contains 14 atoms connected by 14 chemical bonds. The full systematic IUPAC name of this compound is 2,3,4,5,6-pentafluorobenzaldehyde. 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 = 1.9 (positive value, a lipophilic compound), polar surface area PSA = 17.1 Ų, 0 donors and 6 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.

Molecular formula	C7HF5O
Masa molowa	196.07 g/mol
IUPAC	2,3,4,5,6-pentafluorobenzaldehyde
SMILES	C(=O)C1=C(C(=C(C(=C1F)F)F)F)F
InChIKey	QJXCFMJTJYCLFG-UHFFFAOYSA-N
logP (XLogP3)	1.9
PSA	17.1 Ų
HBD / HBA	0 / 6
PubChem CID	CID 69558 ↗

Signal word: Warning

H315 — Działa drażniąco na skórę

H319 — Działa drażniąco na oczy

H332 — Działa szkodliwie w następstwie wdychania

H335 — Może powodować podrażnienie dróg oddechowych

Pentafluorobenzaldehyde · 2,3,4,5,6-Pentafluorobenzaldehyde · 653-37-2 · Perfluorobenzaldehyde · Benzaldehyde, 2,3,4,5,6-pentafluoro- · S9YIE3JZ4K · NSC-96967 · RefChem:859800 · DTXCID802101 · 211-502-6 · Benzaldehyde, pentafluoro- · C7HF5O · MFCD00003303 · EINECS 211-502-6 · QJXCFMJTJYCLFG-UHFFFAOYSA-

• 📊 PubChem CID 69558 — NIH
• 🔬 NIST WebBook — spektroskopia
• 🌐 Wikidata
• 💊 ChEMBL — bioaktywność