benzenesulfonatetrimethyl-[4-[4-[4-(trimethylazaniumyl)phenyl]hexan-3-yl]phenyl]azanium

benzenesulfonate;trimethyl-[4-[4-[4-(trimethylazaniumyl)phenyl]hexan-3-yl]phenyl]azanium

CAS: 24397-06-6

Molecular Formula	`C36H48N2O6S2`
Molecular Weight	668.9 g/mol
Topological Polar Surface Area	131.0 A2
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	7
Exact Mass	668.29535
Heavy Atoms	46
Complexity	531.0

Chemical Identifiers

CAS Number	24397-06-6
SMILES	`CCC(C1=CC=C(C=C1)[N+](C)(C)C)C(CC)C2=CC=C(C=C2)[N+](C)(C)C.C1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-]`
InChIKey	`PTMQBNVKPNRIIF-UHFFFAOYSA-L`

📖 Product Overview

benzenesulfonatetrimethyl-[4-[4-[4-(trimethylazaniumyl)phenyl]hexan-3-yl]phenyl]azanium (CAS: 24397-06-6) is a chemical compound with molecular formula C36H48N2O6S2 and molecular weight 668.9 g/mol. Its IUPAC systematic name is benzenesulfonate;trimethyl-[4-[4-[4-(trimethylazaniumyl)phenyl]hexan-3-yl]phenyl]azanium. Topological Polar Surface Area 131.0 A2 Hydrogen Bond Donors 0 Hydrogen Bond Acceptors 6 Rotatable Bonds 7 Exact Mass 668.29535 Heavy Atoms 46 Complexity 531.0 InChI Key: PTMQBNVKPNRIIF-UHFFFAOYSA-L. SMILES: CCC(C1=CC=C(C=C1)[N+](C)(C)C)C(CC)C2=CC=C(C=C2)[N+](C)(C)C.C1=CC=C(C=C1)S(=O)(=O)[O-].C1=CC=C(C=C1)S(=O)(=O)[O-].

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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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