3-Nitropyridine-2-carboxylic acid
Properties
- Molecular formula
- C6H4N2O4
- Molar mass
- 168.11 g/mol
- Exact mass
- 168.0171 Da
- logP
- 0.69Crippen estimate
- Polar surface area
- 93.3 Ų
- H-bond donors / acceptors
- 1 / 4
- Rotatable bonds
- 2
Hazards
Warning
- H302 Harmful if swallowed100% of notifiers
- H315 Causes skin irritation100% of notifiers
- H319 Causes serious eye irritation100% of notifiers
- H335 May cause respiratory irritation100% of notifiers
Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.
Precautionary statements
P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501
Identifiers
CAS number
59290-85-6SMILES
C1=CC(=C(N=C1)C(=O)O)[N+](=O)[O-]InChIKey
ZUUJWCKWJJGJOE-UHFFFAOYSA-NInChI
InChI=1S/C6H4N2O4/c9-6(10)5-4(8(11)12)2-1-3-7-5/h1-3H,(H,9,10)Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- 3-Nitro-pyridine-2-carboxylic acid
Work with 3-Nitropyridine-2-carboxylic acid
Similar compounds
2-Nitrobenzoic acid552-16-958 % similar
5-Bromo-3-nitropyridine-2-carboxylic acid954240-89-256 % similar
3-Aminopicolinic acid1462-86-855 % similar
3-Nitro-2(1H)-pyridinone6332-56-555 % similar
Quinolinic acid339155-13-454 % similar
Quinolinic acid89-00-954 % similar
3-Nitrophthalic acid603-11-254 % similar
3-Bromopyridine-2-carboxylic acid30683-23-953 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue.