4-Amino-1,1,1-trifluorobut-3-en-2-one

4-Amino-1,1,1-trifluorobut-3-en-2-one is a chemical compound registered under number CAS 184848-89-3, with the molecular formula C₄H₄F₃NO, and a molar mass of 139.08 g/mol.

The molecule contains 13 atoms connected by 12 chemical bonds. The full systematic IUPAC name of this compound is (E)-4-amino-1,1,1-trifluorobut-3-en-2-one. 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 = 1.2 (positive value, a lipophilic compound), polar surface area PSA = 43.1 Ų, 1 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.

Molecular formula	C4H4F3NO
Masa molowa	139.08 g/mol
IUPAC	(E)-4-amino-1,1,1-trifluorobut-3-en-2-one
SMILES	C(=C/N)\C(=O)C(F)(F)F
InChIKey	DHJDPIHFALRNER-OWOJBTEDSA-N
logP (XLogP3)	1.2
PSA	43.1 Ų
HBD / HBA	1 / 5
PubChem CID	CID 5709092 ↗

Signal word: Danger

184848-89-3 · 4-Amino-1,1,1-trifluorobut-3-en-2-one · RefChem:517378 · 641-320-6 · 4-amino-1,1,1-trifluoro-3-buten-2-one · (E)-4-amino-1,1,1-trifluorobut-3-en-2-one · (E)-4-Amino-1,1,1-trifluoro-but-3-en-2-one · 120417-45-0 · MFCD01569588 · 2289675-00-7 · 4-amino-1,1,1-trifluoro-3-butene-2-one · 4-Amino-2-oxo-1,1,1-trifluorobut-3-ene · 2-Trifluoroacetyl vinyl amine · (3E)-4-Amino-1,1,1-trifluoro-3-buten-2-one · 3-Buten-2-one, 4-amino-1,1,1-trifluoro-

• 📊 PubChem CID 5709092 — NIH
• 🔬 NIST WebBook — spektroskopia
• 💊 ChEMBL — bioaktywność