Molecular properties
- Formula
- C6H6ClNO2
- Molar mass
- 159.57 g·mol−1
- Exact mass
- 159.0087 Da
- 4
- PubChem CID
- 129798319
Molecule record
3-chloro-2H-pyridine-3-carboxylic acid
C6H6ClNO2
159.57 g/mol
Loading structure
Functional groups
Alkane / alkyl carbon
Alkene
Alkyl halide
Carboxylic acid
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 3-chloronicotinic acid
- SCHEMBL28687213
Structure identifiers
- Canonical SMILES
- O=C(O)C1(Cl)C=CC=NC1
- Isomeric SMILES
- C1C(C=CC=N1)(C(=O)O)Cl
- InChI
- InChI=1S/C6H6ClNO2/c7-6(5(9)10)2-1-3-8-4-6/h1-3H,4H2,(H,9,10)
- InChIKey
- BWYUYKFJCPPQQF-UHFFFAOYSA-N
- PubChem CID
- 129798319
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 3-chloro-2H-pyridine-3-carboxylic acid; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3-chloro-2H-pyridine-3-carboxylic acid; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.