(3-hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium iodide

CAS: 357-76-6

Molecular Formula	`C16H22INOS`
Molecular Weight	403.3 g/mol
Topological Polar Surface Area	48.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	5
Exact Mass	403.0467
Heavy Atoms	20
Complexity	283.0

Chemical Identifiers

CAS Number	357-76-6
SMILES	`C[N+](C)(C)CCC(C1=CC=CC=C1)(C2=CC=CS2)O.[I-]`
InChIKey	`WSJMOXGMNDDXMQ-UHFFFAOYSA-M`

📖 Product Overview

(3-hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium iodide (CAS: 357-76-6) is a chemical compound with molecular formula C16H22INOS and molecular weight 403.3 g/mol. Its IUPAC systematic name is (3-hydroxy-3-phenyl-3-thiophen-2-ylpropyl)-trimethylazanium iodide. Topological Polar Surface Area 48.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 5 Exact Mass 403.0467 Heavy Atoms 20 Complexity 283.0 InChI Key: WSJMOXGMNDDXMQ-UHFFFAOYSA-M. SMILES: C[N+](C)(C)CCC(C1=CC=CC=C1)(C2=CC=CS2)O.[I-].

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