CAS
2417-72-3 Purity
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2417-72-3 Purity
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The molecular formula is C9H4BrClN2O2.
The molecular weight is 287.50 g/mol.
The IUPAC name is 6-bromo-4-chloro-3-nitroquinoline.
The InChI is InChI=1S/C9H4BrClN2O2/c10-5-1-2-7-6(3-5)9(11)8(4-12-7)13(14)15/h1-4H.
The InChIKey is KHKPVEMMXJCWGP-UHFFFAOYSA-N.
The canonical SMILES is C1=CC2=NC=C(C(=C2C=C1Br)Cl)[N+](=O)[O-].
The CAS number is 723281-72-9.
The EC number is 695-117-2.
The DSSTox Substance ID is DTXSID40621172.
Yes, it is a canonicalized compound according to PubChem.