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Substance Name: 1-Undecanaminium, N-(5-carboxypentyl)-N,N-dimethyl-4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-, hydroxide, inner salt
RN: 145441-35-6
InChIKey: NCHHIFOOABLJFB-UHFFFAOYSA-N

Molecular Formula

  • C19-H22-F17-N-O2

Molecular Weight

  • 619.3538
 
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Names and Synonyms

Synonym

  • N,N-Dimethyl-N-(3-F-octylpropyl)-6-ammoniohexanoate

Systematic Name

  • 1-Undecanaminium, N-(5-carboxypentyl)-N,N-dimethyl-4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoro-, hydroxide, inner salt

Registry Numbers

CAS Registry Number

  • 145441-35-6

System Generated Number

  • 0145441356

Structure Descriptors

InChI

1S/C19H22F17NO2/c1-37(2,9-5-3-4-7-11(38)39)10-6-8-12(20,21)13(22,23)14(24,25)15(26,27)16(28,29)17(30,31)18(32,33)19(34,35)36/h3-10H2,1-2H3

InChIKey

NCHHIFOOABLJFB-UHFFFAOYSA-N

Smiles

C[N+](C)(CCCCCC(=O)[O-])CCCC(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous 250mg/kg (250mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 27, Pg. 891, 1992.