Chemistry:Hexafluronium bromide

Hexafluronium
Clinical data
ATC code	M03AC05 (WHO) ;
Identifiers
	IUPAC name N,N-di-9H-fluoren-9-yl-N,N,N',N'-tetramethylhexane-1,6-diaminium dibromide;
CAS Number	317-52-2 ;
PubChem CID	9434;
DrugBank	DB00941 ;
ChemSpider	9063 ;
UNII	B64NJG83K2;
KEGG	D04435 ;
Chemical and physical data
Formula	C36H42Br2N2
Molar mass	662.554 g·mol−1
3D model (JSmol)	Interactive image;
	SMILES [Br-].[Br-].c1cccc3c1c2c(cccc2)C3[N+](CCCCCC[N+](C6c4ccccc4c5ccccc56)(C)C)(C)C;
	InChI InChI=1S/C36H42N2.2BrH/c1-37(2,35-31-21-11-7-17-27(31)28-18-8-12-22-32(28)35)25-15-5-6-16-26-38(3,4)36-33-23-13-9-19-29(33)30-20-10-14-24-34(30)36;;/h7-14,17-24,35-36H,5-6,15-16,25-26H2,1-4H3;2*1H/q+2;;/p-2 ; Key:WDEFPRUEZRUYNW-UHFFFAOYSA-L ;
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Short description: Pharmaceutical drug

Hexafluronium (or hexafluorenium) is a muscle relaxant.^[1] It acts as a nicotinic acetylcholine receptor antagonist.

References

↑ "Hexafluorenium-suxamethonium interaction in patients with normal versus atypical cholinesterase". British Journal of Anaesthesia 47 (8): 885–8. August 1975. doi:10.1093/bja/47.8.885. PMID 1201167.

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Clinical data

ATC code	M03AC05 (WHO)
Identifiers
IUPAC name N,N-di-9H-fluoren-9-yl-N,N,N',N'-tetramethylhexane-1,6-diaminium dibromide
CAS Number	317-52-2^N
PubChem CID	9434
DrugBank	DB00941^Y
ChemSpider	9063^Y
UNII	B64NJG83K2
KEGG	D04435^Y
Chemical and physical data
Formula	C₃₆H₄₂Br₂N₂
Molar mass	662.554 g·mol⁻¹
3D model (JSmol)	Interactive image
SMILES [Br-].[Br-].c1cccc3c1c2c(cccc2)C3[N+](CCCCCC[N+](C6c4ccccc4c5ccccc56)(C)C)(C)C
InChI InChI=1S/C36H42N2.2BrH/c1-37(2,35-31-21-11-7-17-27(31)28-18-8-12-22-32(28)35)25-15-5-6-16-26-38(3,4)36-33-23-13-9-19-29(33)30-20-10-14-24-34(30)36;;/h7-14,17-24,35-36H,5-6,15-16,25-26H2,1-4H3;2*1H/q+2;;/p-2^Y Key:WDEFPRUEZRUYNW-UHFFFAOYSA-L^Y
^NY (what is this?) (verify)