90923-68-5 Purity
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Specification
The molecular formula of 6-Ethyl isatin is C10H9NO2.
The molecular weight of 6-Ethyl isatin is 175.18 g/mol.
The IUPAC name of 6-Ethyl isatin is 6-ethyl-1H-indole-2,3-dione.
The InChIKey of 6-Ethyl isatin is HLRUCDIVVJMXEB-UHFFFAOYSA-N.
The canonical SMILES notation of 6-Ethyl isatin is CCC1=CC2=C(C=C1)C(=O)C(=O)N2.
The CAS number of 6-Ethyl isatin is 90924-07-5.
The XLogP3 value of 6-Ethyl isatin is 1.6.
6-Ethyl isatin has 1 hydrogen bond donor count.
The topological polar surface area of 6-Ethyl isatin is 46.2 Å2.
Yes, 6-Ethyl isatin is a canonicalized compound.