Phenylacetonitrile

Phenylacetonitrile is a chemical compound registered under number CAS 140-29-4, with the molecular formula C₈H₇N, and a molar mass of 117.15 g/mol.

The molecule contains 16 atoms connected by 16 chemical bonds. The full systematic IUPAC name of this compound is 2-phenylacetonitrile. 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 = 1.6 (positive value, a lipophilic compound), polar surface area PSA = 23.8 Ų, 0 donors and 1 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.

Signal word: Danger

H301 — Działa toksycznie po połknięciu

H311 — Działa toksycznie w kontakcie ze skórą

H330 — Wdychanie grozi śmiercią

H319 — Działa drażniąco na oczy

H372 — Powoduje uszkodzenie narządów poprzez długotrwałe lub powtarzane narażenie

• 📊 PubChem CID 8794 — NIH
• 🔬 NIST WebBook — spektroskopia
• 🌐 Wikidata
• 💊 ChEMBL — bioaktywność