Dimethyl fluoromalonate

Dimethyl fluoromalonate is a chemical compound registered under number CAS 344-14-9, with the molecular formula C₅H₇FO₄, and a molar mass of 150.10 g/mol.

The molecule contains 17 atoms connected by 16 chemical bonds. The full systematic IUPAC name of this compound is dimethyl 2-fluoropropanedioate. 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 = 0.6 (positive value, a lipophilic compound), polar surface area PSA = 52.6 Ų, 0 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	C5H7FO4
Masa molowa	150.10 g/mol
IUPAC	dimethyl 2-fluoropropanedioate
SMILES	COC(=O)C(C(=O)OC)F
InChIKey	ZVXHZSXYHFBIEW-UHFFFAOYSA-N
logP (XLogP3)	0.6
PSA	52.6 Ų
HBD / HBA	0 / 5
PubChem CID	CID 2737111 ↗

Signal word: Danger

H314 — Powoduje poważne oparzenia skóry oraz uszkodzenia oczu

DIMETHYL FLUOROMALONATE · 344-14-9 · RefChem:134240 · DTXCID20322877 · 670-542-6 · dimethyl 2-fluoromalonate · dimethyl 2-fluoropropanedioate · dimethylfluoromalonate · 2-fluoro-malonic acid dimethyl ester · MFCD00054680 · C5H7FO4 · dimethyl fluoropropanedioate · dimethyl2-fluoromalonate · 1,3-dimethyl 2-fluoropropanedioate · Propanedioic acid, fluoro-, dimethyl ester

• 📊 PubChem CID 2737111 — NIH
• 🔬 NIST WebBook — spektroskopia
• 🌐 Wikidata
• 💊 ChEMBL — bioaktywność