(p-Bromophenacyl)dimethyl(2-hydroxy-3-(1-naphthyloxy)propyl)ammonium bromide

[2-(4-bromophenyl)-2-oxoethyl]-(2-hydroxy-3-naphthalen-1-yloxypropyl)-dimethylazanium bromide

CAS: 87415-51-8

Molecular Formula	`C23H25Br2NO3`
Molecular Weight	523.3 g/mol
Topological Polar Surface Area	46.5 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	4
Rotatable Bonds	8
Exact Mass	523.01807
Heavy Atoms	29
Complexity	504.0

Chemical Identifiers

CAS Number	87415-51-8
SMILES	`C[N+](C)(CC(COC1=CC=CC2=CC=CC=C21)O)CC(=O)C3=CC=C(C=C3)Br.[Br-]`
InChIKey	`SPJIXNAXZLMRAI-UHFFFAOYSA-M`

📖 Product Overview

(p-Bromophenacyl)dimethyl(2-hydroxy-3-(1-naphthyloxy)propyl)ammonium bromide (CAS: 87415-51-8) is a chemical compound with molecular formula C23H25Br2NO3 and molecular weight 523.3 g/mol. Its IUPAC systematic name is [2-(4-bromophenyl)-2-oxoethyl]-(2-hydroxy-3-naphthalen-1-yloxypropyl)-dimethylazanium bromide. Topological Polar Surface Area 46.5 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 4 Rotatable Bonds 8 Exact Mass 523.01807 Heavy Atoms 29 Complexity 504.0 InChI Key: SPJIXNAXZLMRAI-UHFFFAOYSA-M. SMILES: C[N+](C)(CC(COC1=CC=CC2=CC=CC=C21)O)CC(=O)C3=CC=C(C=C3)Br.[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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