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The molecular formula is C11H13BrO2.
The synonyms include 38473-89-1, 3-bromo-4-tert-butylbenzoic acid, and 3-Bromo-4-(tert-butyl)benzoic acid.
The molecular weight is 257.12 g/mol.
It was created on March 26, 2005.
It was last modified on December 2, 2023.
The IUPAC name is 3-bromo-4-tert-butylbenzoic acid.
The InChI is InChI=1S/C11H13BrO2/c1-11(2,3)8-5-4-7(10(13)14)6-9(8)12/h4-6H,1-3H3,(H,13,14).
The InChIKey is SHBYNNKZVBDWRW-UHFFFAOYSA-N.
The canonical SMILES is CC(C)(C)C1=C(C=C(C=C1)C(=O)O)Br.
The CAS number is 38473-89-1.
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