aluminum 2-(3-hydroxy-5-sulfo-1H-indol-2-yl)-3-oxoindole-5-sulfonic acid

CAS: 16521-38-3

Molecular Formula	`C16H10AlN2O8S2+3`
Molecular Weight	449.4 g/mol
Topological Polar Surface Area	191.0 A2
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	9
Rotatable Bonds	3
Exact Mass	448.9694
Heavy Atoms	29
Complexity	904.0

Chemical Identifiers

CAS Number	16521-38-3
SMILES	`C1=CC2=C(C=C1S(=O)(=O)O)C(=C(N2)C3=NC4=C(C3=O)C=C(C=C4)S(=O)(=O)O)O.[Al+3]`
InChIKey	`INHYHTBURMMHBG-UHFFFAOYSA-N`

📖 Product Overview

aluminum 2-(3-hydroxy-5-sulfo-1H-indol-2-yl)-3-oxoindole-5-sulfonic acid (CAS: 16521-38-3) is a chemical compound with molecular formula C16H10AlN2O8S2+3 and molecular weight 449.4 g/mol. Its IUPAC systematic name is aluminum 2-(3-hydroxy-5-sulfo-1H-indol-2-yl)-3-oxoindole-5-sulfonic acid. Topological Polar Surface Area 191.0 A2 Hydrogen Bond Donors 4 Hydrogen Bond Acceptors 9 Rotatable Bonds 3 Exact Mass 448.9694 Heavy Atoms 29 Complexity 904.0 InChI Key: INHYHTBURMMHBG-UHFFFAOYSA-N. SMILES: C1=CC2=C(C=C1S(=O)(=O)O)C(=C(N2)C3=NC4=C(C3=O)C=C(C=C4)S(=O)(=O)O)O.[Al+3].

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