Molecular properties
- Formula
- C8H5N3
- Molar mass
- 143.15 g·mol−1
- Exact mass
- 143.0483 Da
- 8
- PubChem CID
- 843858
Molecule record
1H-benzimidazole-2-carbonitrile
C8H5N3
143.15 g/mol
Loading structure
Functional groups
Aromatic ring
Nitrile
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 1H-1,3-Benzimidazole-2-carbonitrile
- 1H-1,3-benzodiazole-2-carbonitrile
- 1H-Benzo[d]imidazole-2-carbonitrile
- 2-BENZIMIDAZOLCARBONITRILE
- 2-Benzimidazolecarbonitrile
- 2-cyanobenzimidazole
- 6868-37-7
- AKOS000599636
Show all 24 synonyms
- ALBB-026096
- AS-42121
- CHEMBL4860178
- DTXCID40308173
- DTXSID70357114
- FB133513
- HMS1682P06
- MFCD00493627
- RefChem:237585
- SBB072845
- SCHEMBL11467414
- SCHEMBL15421643
- SCHEMBL244929
- SCHEMBL31677104
- VEKMJKMSTPFHQD-UHFFFAOYSA-N
- benzimidazole-2-carbonitrile
Structure identifiers
- Canonical SMILES
- N#Cc1nc2ccccc2[nH]1
- Isomeric SMILES
- C1=CC=C2C(=C1)NC(=N2)C#N
- InChI
- InChI=1S/C8H5N3/c9-5-8-10-6-3-1-2-4-7(6)11-8/h1-4H,(H,10,11)
- InChIKey
- VEKMJKMSTPFHQD-UHFFFAOYSA-N
- PubChem CID
- 843858
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 1H-benzimidazole-2-carbonitrile; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 1H-benzimidazole-2-carbonitrile; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.