CAS
14704-31-5 Purity
98%
14704-31-5 Purity
98%
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The molecular formula is C9H6BrNO2.
The molecular weight is 240.05 g/mol.
The IUPAC name is 4-bromo-5-methyl-1H-indole-2,3-dione.
The InChI is InChI=1S/C9H6BrNO2/c1-4-2-3-5-6(7(4)10)8(12)9(13)11-5/h2-3H,1H3,(H,11,12,13).
The InChIKey is DKAVQCARZCYRIS-UHFFFAOYSA-N.
The Canonical SMILES is CC1=C(C2=C(C=C1)NC(=O)C2=O)Br.
The CAS number is 147149-84-6.
The EC number is 687-910-7.
Yes, it is a canonicalized compound according to PubChem.