Structure via PubChem · Public domain (PubChem)
Chemical data
- Formula
- C7H5NO4
- Molecular weight
- 167.12 g/mol
- IUPAC name
- 3-nitrobenzoic acid
- SMILES
- C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)O
- InChIKey
- AFPHTEQTJZKQAQ-UHFFFAOYSA-N
- XLogP
- 1.8
- Polar surface area
- 83.1 Ų
- H-bond donors
- 1
- H-bond acceptors
- 4
- Formal charge
- 0
via PubChem
Drug data · ChEMBL
- Molecule type
- Small molecule
via ChEMBL · EBI
Wikidata facts
- Subclass of
- chemical compound
- Has part
- carbon
- Mass
- 167.022
Show 6 more facts
- pKa
- 3.47
- melting point
- 142.0
- density
- 1.494
- chemical formula
- C₇H₅NO₄
- canonical SMILES
- C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)O
- Commons category
- 3-Nitrobenzoic acid
Sources (2)
via Wikidata · CC0