Dimethyl(2-hydroxyethyl)pentylammonium bromide benzilate

2-(2-hydroxy-2,2-diphenylacetyl)oxyethyl-dimethyl-pentylazanium bromide

CAS: 56927-39-0

Molecular Formula	`C23H32BrNO3`
Molecular Weight	450.4 g/mol
Topological Polar Surface Area	46.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	11
Exact Mass	449.15656
Heavy Atoms	28
Complexity	419.0

Chemical Identifiers

CAS Number	56927-39-0
SMILES	`CCCCC[N+](C)(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Br-]`
InChIKey	`FOPWIKCTANOJML-UHFFFAOYSA-M`

📖 Product Overview

Dimethyl(2-hydroxyethyl)pentylammonium bromide benzilate (CAS: 56927-39-0) is a chemical compound with molecular formula C23H32BrNO3 and molecular weight 450.4 g/mol. Its IUPAC systematic name is 2-(2-hydroxy-2,2-diphenylacetyl)oxyethyl-dimethyl-pentylazanium bromide. Topological Polar Surface Area 46.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 11 Exact Mass 449.15656 Heavy Atoms 28 Complexity 419.0 InChI Key: FOPWIKCTANOJML-UHFFFAOYSA-M. SMILES: CCCCC[N+](C)(C)CCOC(=O)C(C1=CC=CC=C1)(C2=CC=CC=C2)O.[Br-].

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