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Molecule record

4-fluoropyrimidine

C4H3FN2

98.08 g/mol

Loading structure

Molecular properties

Formula
C4H3FN2
Molar mass
98.08 g·mol−1
Exact mass
98.0280 Da
4
PubChem CID
19595920

Functional groups

Aromatic ring
Aryl halide

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 31462-55-2
  • 4-Fluoro-pyrimidine
  • 6-fluoropyrimidine
  • DB-068468
  • DTXCID40549680
  • DTXSID90598921
  • E86814
  • MFCD16294306
Show all 16 synonyms
  • RefChem:292934
  • SB55534
  • SCHEMBL2049843
  • SCHEMBL446894
  • SCHEMBL447097
  • SCHEMBL450929
  • SCHEMBL6260468
  • SY410980

Structure identifiers

Canonical SMILES
Fc1ccncn1
Isomeric SMILES
C1=CN=CN=C1F
InChI
InChI=1S/C4H3FN2/c5-4-1-2-6-3-7-4/h1-3H
InChIKey
ZBCSZYVDLLOFMU-UHFFFAOYSA-N
PubChem CID
19595920

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 4-fluoropyrimidine; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 4-fluoropyrimidine; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

PubChem(link only)
Open source record