1219813-78-1 Purity
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Specification
The molecular formula of 5-Bromo-1H-indazole-3-carboxylic acid is C8H5BrN2O2.
The molecular weight of 5-Bromo-1H-indazole-3-carboxylic acid is 241.04 g/mol.
The IUPAC name of 5-Bromo-1H-indazole-3-carboxylic acid is 5-bromo-1H-indazole-3-carboxylic acid.
The InChI of 5-Bromo-1H-indazole-3-carboxylic acid is InChI=1S/C8H5BrN2O2/c9-4-1-2-6-5(3-4)7(8(12)13)11-10-6/h1-3H,(H,10,11)(H,12,13).
The InChIKey of 5-Bromo-1H-indazole-3-carboxylic acid is AMJVXOOGGBPVCZ-UHFFFAOYSA-N.
The canonical SMILES of 5-Bromo-1H-indazole-3-carboxylic acid is C1=CC2=C(C=C1Br)C(=NN2)C(=O)O.
The CAS number of 5-Bromo-1H-indazole-3-carboxylic acid is 1077-94-7.
The XLogP3-AA value of 5-Bromo-1H-indazole-3-carboxylic acid is 2.1.
5-Bromo-1H-indazole-3-carboxylic acid has 2 hydrogen bond donor counts.
5-Bromo-1H-indazole-3-carboxylic acid has 3 hydrogen bond acceptor counts.