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The molecular formula is C8H4BrNO3.
Some synonyms include 944898-67-3, 7-Bromobenzo[d]oxazole-2-carboxylic acid, and 7-BROMO-BENZOOXAZOLE-2-CARBOXYLIC ACID.
The molecular weight is 242.03 g/mol.
It was created on October 30, 2011, and modified on December 30, 2023.
The IUPAC name is 7-bromo-1,3-benzoxazole-2-carboxylic acid.
The InChI is InChI=1S/C8H4BrNO3/c9-4-2-1-3-5-6(4)13-7(10-5)8(11)12/h1-3H,(H,11,12).
The InChIKey is HLHBIBCQALAVTP-UHFFFAOYSA-N.
The canonical SMILES is C1=CC2=C(C(=C1)Br)OC(=N2)C(=O)O.
The CAS number is 944898-67-3.
The molecular weight is 242.03 g/mol, XLogP3-AA is 2.3, it has 1 hydrogen bond donor count, and 4 hydrogen bond acceptor count.
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