Compound C16H26I2N2S

1-(5-dimethylsulfonio-1H-indol-3-yl)propan-2-yl-trimethylazanium diiodide

CAS: 5564-14-7

Molecular Formula	`C16H26I2N2S`
Molecular Weight	532.3 g/mol
Topological Polar Surface Area	16.8 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	2
Rotatable Bonds	4
Exact Mass	531.9906
Heavy Atoms	21
Complexity	298.0

Chemical Identifiers

CAS Number	5564-14-7
SMILES	`CC(CC1=CNC2=C1C=C(C=C2)[S+](C)C)[N+](C)(C)C.[I-].[I-]`
InChIKey	`GMLSBNSOTOCJIX-UHFFFAOYSA-L`

📖 Product Overview

Compound C16H26I2N2S (CAS: 5564-14-7) is a chemical compound with molecular formula C16H26I2N2S and molecular weight 532.3 g/mol. Its IUPAC systematic name is 1-(5-dimethylsulfonio-1H-indol-3-yl)propan-2-yl-trimethylazanium diiodide. Topological Polar Surface Area 16.8 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 2 Rotatable Bonds 4 Exact Mass 531.9906 Heavy Atoms 21 Complexity 298.0 InChI Key: GMLSBNSOTOCJIX-UHFFFAOYSA-L. SMILES: CC(CC1=CNC2=C1C=C(C=C2)[S+](C)C)[N+](C)(C)C.[I-].[I-].

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