106698-07-1 Purity
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The molecular formula of 2-Bromo-4'-nitroacetophenone is C8H6BrNO3.
The molecular weight of 2-Bromo-4'-nitroacetophenone is 244.04 g/mol.
The IUPAC name of 2-Bromo-4'-nitroacetophenone is 2-bromo-1-(4-nitrophenyl)ethanone.
The InChI of 2-Bromo-4'-nitroacetophenone is InChI=1S/C8H6BrNO3/c9-5-8(11)6-1-3-7(4-2-6)10(12)13/h1-4H,5H2.
The InChIKey of 2-Bromo-4'-nitroacetophenone is MBUPVGIGAMCMBT-UHFFFAOYSA-N.
The canonical SMILES of 2-Bromo-4'-nitroacetophenone is C1=CC(=CC=C1C(=O)CBr)[N+](=O)[O-].
The CAS number of 2-Bromo-4'-nitroacetophenone is 99-81-0.
The EC number of 2-Bromo-4'-nitroacetophenone is 202-789-9.
The ChEMBL ID of 2-Bromo-4'-nitroacetophenone is CHEMBL106072.
The XLogP3 value of 2-Bromo-4'-nitroacetophenone is 2.3.