Molecule record

2-bromopyrimidine

C4H3BrN2

158.99 g/mol

Loading structure

Molecular properties

Formula
C4H3BrN2
Molar mass
158.99 g·mol−1
Exact mass
157.9480 Da
4
PubChem CID
78345

Functional groups

Aromatic ring
Aryl halide

Physical properties

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

Common names and synonyms

  • 2-Bromopyrimidine, 95%
  • 2-bromo-pyrimidine
  • 224-993-7
  • 4595-60-2
  • A1BDM
  • BDBM50622796
  • CHEMBL5414935
  • DTXCID1040459
Show all 24 synonyms
  • DTXSID9063532
  • EBC-77062
  • EINECS 224-993-7
  • MFCD00014601
  • NS3RKG8A3U
  • NSC 88935
  • NSC88935
  • PGFIHORVILKHIA-UHFFFAOYSA-N
  • Pyrimidine, 2-bromo-
  • RefChem:85904
  • SBB054484
  • SCHEMBL446545
  • SCHEMBL449021
  • SCHEMBL5162
  • STR08642
  • bromopyrimidine

Structure identifiers

Canonical SMILES
Brc1ncccn1
Isomeric SMILES
C1=CN=C(N=C1)Br
InChI
InChI=1S/C4H3BrN2/c5-4-6-2-1-3-7-4/h1-3H
InChIKey
PGFIHORVILKHIA-UHFFFAOYSA-N
PubChem CID
78345

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 2-bromopyrimidine; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 2-bromopyrimidine; not experimental data.

Sources

Molecule identity

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

Open source record