(4-cyclohexyl-4-hydroxy-4-phenylbut-2-ynyl)-diethyl-methylazanium bromide

CAS: 2110-44-3

Molecular Formula	`C21H32BrNO`
Molecular Weight	394.4 g/mol
Topological Polar Surface Area	20.2 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	2
Rotatable Bonds	6
Exact Mass	393.16672
Heavy Atoms	24
Complexity	416.0

Chemical Identifiers

CAS Number	2110-44-3
SMILES	`CC[N+](C)(CC)CC#CC(C1CCCCC1)(C2=CC=CC=C2)O.[Br-]`
InChIKey	`ONJDEBPQOLJIOJ-UHFFFAOYSA-M`

📖 Product Overview

(4-cyclohexyl-4-hydroxy-4-phenylbut-2-ynyl)-diethyl-methylazanium bromide (CAS: 2110-44-3) is a chemical compound with molecular formula C21H32BrNO and molecular weight 394.4 g/mol. Its IUPAC systematic name is (4-cyclohexyl-4-hydroxy-4-phenylbut-2-ynyl)-diethyl-methylazanium bromide. Topological Polar Surface Area 20.2 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 2 Rotatable Bonds 6 Exact Mass 393.16672 Heavy Atoms 24 Complexity 416.0 InChI Key: ONJDEBPQOLJIOJ-UHFFFAOYSA-M. SMILES: CC[N+](C)(CC)CC#CC(C1CCCCC1)(C2=CC=CC=C2)O.[Br-].

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.

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