diethyl-(4-hydroxy-4-phenyl-4-pyridin-2-ylbut-2-ynyl)-methylazanium bromide

CAS: 2110-31-8

Molecular Formula	`C20H25BrN2O`
Molecular Weight	389.3 g/mol
Topological Polar Surface Area	33.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	3
Rotatable Bonds	6
Exact Mass	388.11502
Heavy Atoms	24
Complexity	425.0

Chemical Identifiers

CAS Number	2110-31-8
SMILES	`CC[N+](C)(CC)CC#CC(C1=CC=CC=C1)(C2=CC=CC=N2)O.[Br-]`
InChIKey	`YTMCJJJPDORKBE-UHFFFAOYSA-M`

📖 Product Overview

diethyl-(4-hydroxy-4-phenyl-4-pyridin-2-ylbut-2-ynyl)-methylazanium bromide (CAS: 2110-31-8) is a chemical compound with molecular formula C20H25BrN2O and molecular weight 389.3 g/mol. Its IUPAC systematic name is diethyl-(4-hydroxy-4-phenyl-4-pyridin-2-ylbut-2-ynyl)-methylazanium bromide. Topological Polar Surface Area 33.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 3 Rotatable Bonds 6 Exact Mass 388.11502 Heavy Atoms 24 Complexity 425.0 InChI Key: YTMCJJJPDORKBE-UHFFFAOYSA-M. SMILES: CC[N+](C)(CC)CC#CC(C1=CC=CC=C1)(C2=CC=CC=N2)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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📚 Academic Support

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