1-fluoropyrimidine-2,4-dione (CED0188317)

Record Information

Version

1.0

Creation Date

2026-08-22 16:18:25 UTC

Update Date

2026-08-22 16:18:25 UTC

Accession Number

CHEM217836

Identification

Common Name

1-fluoropyrimidine-2,4-dione

Class

Small Molecule

Description

1-fluoropyrimidine-2,4-dione (C4H3FN2O2) is an organic compound with an average molecular weight of 130.08 g/mol. 1-fluoropyrimidine-2,4-dione belongs to the pyrimidines and pyrimidine derivatives, a subclass of diazines within the organic compounds. The compound is found in or released from four recorded sources. These include electrical and electronic equipment, specifically antennas and video games, as well as household cleaning and consumer products, specifically pipe accessories and other smoking requisites.

Contaminant Type

Not Available

Chemical Structure

MOL SDF PDB SMILES InChI

Synonyms

Not Available

Chemical Formula

C₄H₃FN₂O₂

Average Molecular Mass

130.080 g/mol

Monoisotopic Mass

130.018 g/mol

CAS Registry Number

Not Available

IUPAC Name

Not Available

Traditional Name

Not Available

SMILES

Not Available

InChI Identifier

InChI=1S/C4H3FN2O2/c5-7-2-1-3(8)6-4(7)9/h1-2H,(H,6,8,9)

InChI Key

SNKDCTFPQUHAPR-UHFFFAOYSA-N

Chemical Taxonomy

Classification

Not classified

Biological Properties

Status

Detected and Not Quantified

Origin

Not Available

Cellular Locations

Not Available

Biofluid Locations

Not Available

Tissue Locations

Not Available

Applications

Not Available

Biological Roles

Not Available

Chemical Roles

Not Available

Organoleptic Effects

Not Available

Physical Properties

State

Not Available

Appearance

Not Available

Experimental Properties

Property	Value
Melting Point	Not Available
Boiling Point	Not Available
Solubility	Not Available

Predicted Properties

Not Available

Spectra

Spectrum Type	Description	Splash Key	Deposition Date	View
Predicted GC-MS	Predicted GC-MS Spectrum	splash10-05qi-9200000000-d1bda9da3dfcb425b5cd	Not Available	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum	Not Available	Not Available	View Spectrum

Toxicity Profile

Mechanism of Toxicity

Not Available

Carcinogenicity (IARC Classification)

Not Available

Minimum Risk Level

Not Available

Symptoms

Not Available

Treatment

Not Available

Toxicity Values

Toxicity Value	Unit	Value Range	Organism	Dose Descriptor	Route of Exposure	Predicted or Experimental	Reference
450.0	Log mg/kg	[250:800]	Rat	LD50	oral	predicted	Not Available

Health Effects

Health Effect	Relationship	Direction	Reference

Exposure Sources

Source ID	Source	Sector	Reference
506	Antennas	Electrical & Electronic Equipment	Not Available
539	Video Games	Electrical & Electronic Equipment	Not Available
560	Other Smoking Requisites	Household cleaning & consumer products	Not Available
562	Pipe Accessories	Household cleaning & consumer products	Not Available

Pathways

0 pathways

No pathways found

No metabolic pathways have been associated with this synthetic chemical

Targets

Structure	Protein	UniProt ID	Organism	Relationship	Details
Click to view 3D structure	Dihydrolipoyl dehydrogenase	P9WHH9	Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)	Predicted (SEA)	168.154
Click to view 3D structure	Dihydrolipoyllysine-residue acetyltransferase component of pyruvate dehydrogenase complex	P9WIS7	Mycobacterium tuberculosis (strain ATCC 25618 / H37Rv)	Predicted (SEA)	159.046
Click to view 3D structure	Tyrosyl-DNA phosphodiesterase 2	O95551	Humans	Predicted (SEA)	324.086
Click to view 3D structure	Replicase polyprotein 1ab	P0DTD1	SARS-CoV-2	Predicted (SEA)	2396.12
Click to view 3D structure	Protein RecA	P9WHJ3	Mycobacterium tuberculosis	Predicted (SEA)	3487.57
Click to view 3D structure	D-amino-acid oxidase	P14920	Humans	Predicted (SEA)	322.218
Click to view 3D structure	Lysine-specific demethylase 4A	O75164	Humans	Predicted (SEA)	982.379
Click to view 3D structure	Carbonic anhydrase 12	O43570	Humans	Predicted (SEA)	3608.62
Click to view 3D structure	Induced myeloid leukemia cell differentiation protein Mcl-1	Q07820	Humans	Predicted (SEA)	3544.94
Click to view 3D structure	Carbonic anhydrase 2	P00918	Humans	Predicted (SEA)	4359.48
Click to view 3D structure	Reverse transcriptase/RNaseH	Q72547	Human immunodeficiency virus 1	Predicted (SEA)	1004.49
Click to view 3D structure	Cytochrome P450 2C9	P11712	Humans	Predicted (SEA)	7282.95
Click to view 3D structure	Acetylcholinesterase	P22303	Humans	Predicted (SEA)	4964.44
Click to view 3D structure	Carbonic anhydrase 9	Q16790	Humans	Predicted (SEA)	4042.71
Click to view 3D structure	Carbonic anhydrase 1	P00915	Humans	Predicted (SEA)	4255.08
Click to view 3D structure	Indoleamine 2,3-dioxygenase 1	P14902	Humans	Predicted (SEA)	2273.2
Click to view 3D structure	Apoptotic protease-activating factor 1	O14727	Humans	Predicted (SEA)	2192.31
Click to view 3D structure	D-amino-acid oxidase	O35078	Rattus norvegicus	Predicted (SEA)	60.411
Click to view 3D structure	Lysine-specific demethylase 4C	Q9H3R0	Humans	Predicted (SEA)	2299.9
Click to view 3D structure	Tyrosinase	O42713	Agaricus bisporus	Predicted (SEA)	259.082
Click to view 3D structure	Cytochrome P450 1A2	P05177	Humans	Predicted (SEA)	7137.76
Click to view 3D structure	Tyrosinase	P14679	Humans	Predicted (SEA)	257.447
Click to view 3D structure	Cytochrome P450 2D6	P10635	Humans	Predicted (SEA)	7359.55
Click to view 3D structure	Cholinesterase	P06276	Humans	Predicted (SEA)	4451.57
Click to view 3D structure	Dual specificity protein phosphatase 6	Q64346	Rattus norvegicus	Predicted (SEA)	999.195