(2-(alpha-(alpha,alpha,alpha-Trifluoro-m-tolyl)benzyloxy)ethyl)trimethylammonium iodide

trimethyl-[2-[phenyl-[3-(trifluoromethyl)phenyl]methoxy]ethyl]azanium iodide

CAS: 1868-72-0

Molecular Formula	`C19H23F3INO`
Molecular Weight	465.3 g/mol
Topological Polar Surface Area	9.2 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	5
Rotatable Bonds	6
Exact Mass	465.07764
Heavy Atoms	25
Complexity	372.0

Chemical Identifiers

CAS Number	1868-72-0
SMILES	`C[N+](C)(C)CCOC(C1=CC=CC=C1)C2=CC(=CC=C2)C(F)(F)F.[I-]`
InChIKey	`BMNFSSZOYTXTOZ-UHFFFAOYSA-M`

📖 Product Overview

(2-(alpha-(alpha,alpha,alpha-Trifluoro-m-tolyl)benzyloxy)ethyl)trimethylammonium iodide (CAS: 1868-72-0) is a chemical compound with molecular formula C19H23F3INO and molecular weight 465.3 g/mol. Its IUPAC systematic name is trimethyl-[2-[phenyl-[3-(trifluoromethyl)phenyl]methoxy]ethyl]azanium iodide. Topological Polar Surface Area 9.2 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 5 Rotatable Bonds 6 Exact Mass 465.07764 Heavy Atoms 25 Complexity 372.0 InChI Key: BMNFSSZOYTXTOZ-UHFFFAOYSA-M. SMILES: C[N+](C)(C)CCOC(C1=CC=CC=C1)C2=CC(=CC=C2)C(F)(F)F.[I-].

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