93781-93-2 Purity
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Specification
The molecular formula is C8H4Cl3NO3S.
The molecular weight is 300.5 g/mol.
The compound was created on 2005-08-08 and last modified on 2023-12-30.
The IUPAC name is 3,3-dichloro-2-oxo-1H-indole-5-sulfonyl chloride.
The InChI is InChI=1S/C8H4Cl3NO3S/c9-8(10)5-3-4(16(11,14)15)1-2-6(5)12-7(8)13/h1-3H,(H,12,13).
The InChIKey is XXQVRYBFEWKZBM-UHFFFAOYSA-N.
The Canonical SMILES is C1=CC2=C(C=C1S(=O)(=O)Cl)C(C(=O)N2)(Cl)Cl.
The CAS number is 93783-15-4.
The XLogP3-AA value is 2.
Yes, the compound is canonicalized according to PubChem.