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The molecular formula is C13H15BrN2O2.
The molecular weight is 311.17 g/mol.
The compound was created on October 30, 2011.
The compound was last modified on December 2, 2023.
The IUPAC name is tert-butyl 5-bromo-3-methylindazole-1-carboxylate.
The InChI is InChI=1S/C13H15BrN2O2/c1-8-10-7-9(14)5-6-11(10)16(15-8)12(17)18-13(2,3)4/h5-7H,1-4H3.
The InChIKey is LPOXPRHHNYSYCQ-UHFFFAOYSA-N.
The canonical SMILES is CC1=NN(C2=C1C=C(C=C2)Br)C(=O)OC(C)(C)C.
The XLogP3-AA value is 3.9.
The hydrogen bond donor count is 0.
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