Molecular properties
- Formula
- C6H4N2
- Molar mass
- 104.11 g·mol−1
- Exact mass
- 104.0374 Da
- 6
- PubChem CID
- 79
Molecule record
pyridine-3-carbonitrile
C6H4N2
104.11 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
- 100-54-9
- 202-863-0
- 3-Azabenzonitrile
- 3-Cyjanopirydyna
- 3-PYRIDINECARBONITRILE
- 3-Pyridinecarbonitrile, 98%
- 3-Pyridinecarboxylic acid, nitrile
- 3-Pyridinenitrile
Show all 24 synonyms
- 3-Pyridyl cyanide
- 3-Pyridylcarbonitrile
- 3-cyanopyridine
- BRN 0107711
- CHEBI:86556
- DTXCID606665
- DTXSID1026665
- EC 202-863-0
- MFCD00006372
- NSC-17558
- Nicotinic acid nitrile
- Nicotinonitrile
- Nitryl kwasu nikotynowego
- Pyridine, 3-cyano-
- RefChem:505106
- X64V0K6260
Structure identifiers
- Canonical SMILES
- N#Cc1cccnc1
- Isomeric SMILES
- C1=CC(=CN=C1)C#N
- InChI
- InChI=1S/C6H4N2/c7-4-6-2-1-3-8-5-6/h1-3,5H
- InChIKey
- GZPHSAQLYPIAIN-UHFFFAOYSA-N
- PubChem CID
- 79
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 pyridine-3-carbonitrile; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for pyridine-3-carbonitrile; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.