Ambutonium bromide

(4-amino-4-oxo-3,3-diphenylbutyl)-ethyl-dimethylazanium bromide

CAS: 115-51-5

Molecular Formula	`C20H27BrN2O`
Molecular Weight	391.3 g/mol
Topological Polar Surface Area	43.1 A2
Hydrogen Bond Donors	1
Hydrogen Bond Acceptors	2
Rotatable Bonds	7
Exact Mass	390.13068
Heavy Atoms	24
Complexity	361.0

Chemical Identifiers

CAS Number	115-51-5
SMILES	`CC[N+](C)(C)CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N.[Br-]`
InChIKey	`VTAGVKVPFBOVRM-UHFFFAOYSA-N`

📖 Product Overview

Ambutonium bromide (CAS: 115-51-5) is a chemical compound with molecular formula C20H27BrN2O and molecular weight 391.3 g/mol. Its IUPAC systematic name is (4-amino-4-oxo-3,3-diphenylbutyl)-ethyl-dimethylazanium bromide. Topological Polar Surface Area 43.1 A2 Hydrogen Bond Donors 1 Hydrogen Bond Acceptors 2 Rotatable Bonds 7 Exact Mass 390.13068 Heavy Atoms 24 Complexity 361.0 InChI Key: VTAGVKVPFBOVRM-UHFFFAOYSA-N. SMILES: CC[N+](C)(C)CCC(C1=CC=CC=C1)(C2=CC=CC=C2)C(=O)N.[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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