[4-[5-[4-[dimethyl(prop-2-enyl)azaniumyl]phenyl]-3-oxopentyl]phenyl]-dimethyl-prop-2-enylazanium dibromide

CAS: 402-40-4

Molecular Formula	`C27H38Br2N2O`
Molecular Weight	566.4 g/mol
Topological Polar Surface Area	17.1 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	3
Rotatable Bonds	12
Exact Mass	566.13306
Heavy Atoms	32
Complexity	501.0

Chemical Identifiers

CAS Number	402-40-4
SMILES	`C[N+](C)(CC=C)C1=CC=C(C=C1)CCC(=O)CCC2=CC=C(C=C2)[N+](C)(C)CC=C.[Br-].[Br-]`
InChIKey	`WKDURMTZOWGWTD-UHFFFAOYSA-L`

📖 Product Overview

[4-[5-[4-[dimethyl(prop-2-enyl)azaniumyl]phenyl]-3-oxopentyl]phenyl]-dimethyl-prop-2-enylazanium dibromide (CAS: 402-40-4) is a chemical compound with molecular formula C27H38Br2N2O and molecular weight 566.4 g/mol. Its IUPAC systematic name is [4-[5-[4-[dimethyl(prop-2-enyl)azaniumyl]phenyl]-3-oxopentyl]phenyl]-dimethyl-prop-2-enylazanium dibromide. Topological Polar Surface Area 17.1 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 3 Rotatable Bonds 12 Exact Mass 566.13306 Heavy Atoms 32 Complexity 501.0 InChI Key: WKDURMTZOWGWTD-UHFFFAOYSA-L. SMILES: C[N+](C)(CC=C)C1=CC=C(C=C1)CCC(=O)CCC2=CC=C(C=C2)[N+](C)(C)CC=C.[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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Multi-source research profile: chemical properties, regulatory status, and sourcing guide for [4-[5-[4-[dimethyl(prop-2-enyl)azaniumyl]phenyl]-3-oxopentyl]phenyl]-dimethyl-prop-2-enylazanium dibromide.

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