75806-85-8 Purity
98%
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Specification
The molecular formula of 5-Bromo-3-nitropyridine-2-carboxylic acid is C6H3BrN2O4.
The PubChem CID of 5-Bromo-3-nitropyridine-2-carboxylic acid is 45790029.
The IUPAC name of 5-Bromo-3-nitropyridine-2-carboxylic acid is 5-bromo-3-nitropyridine-2-carboxylic acid.
The InChI of 5-Bromo-3-nitropyridine-2-carboxylic acid is InChI=1S/C6H3BrN2O4/c7-3-1-4(9(12)13)5(6(10)11)8-2-3/h1-2H,(H,10,11).
The InChIKey of 5-Bromo-3-nitropyridine-2-carboxylic acid is NLHXGZDQNSRWHH-UHFFFAOYSA-N.
The canonical SMILES of 5-Bromo-3-nitropyridine-2-carboxylic acid is C1=C(C=NC(=C1[N+](=O)[O-])C(=O)O)Br.
The molecular weight of 5-Bromo-3-nitropyridine-2-carboxylic acid is 247.00 g/mol.
The XLogP3-AA value of 5-Bromo-3-nitropyridine-2-carboxylic acid is 1.2.
5-Bromo-3-nitropyridine-2-carboxylic acid has 1 hydrogen bond donor count.
5-Bromo-3-nitropyridine-2-carboxylic acid has 5 hydrogen bond acceptor counts.