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Substance Name: 1-Hexanaminium, N-(carboxymethyl)-N,N-dimethyl-3,3,4,4,5,5,6,6,6-nonafluoro-, hydroxide, inner salt
RN: 145441-30-1
InChIKey: VQTNPRGLRDLXML-UHFFFAOYSA-N

Molecular Formula

  • C10-H12-F9-N-O2

Molecular Weight

  • 349.1918
 
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Names and Synonyms

Synonym

  • N,N-Dimethyl-N-(2-F-butylethyl)ammonioacetate

Systematic Name

  • 1-Hexanaminium, N-(carboxymethyl)-N,N-dimethyl-3,3,4,4,5,5,6,6,6-nonafluoro-, hydroxide, inner salt

Registry Numbers

CAS Registry Number

  • 145441-30-1

System Generated Number

  • 0145441301

Structure Descriptors

InChI

1S/C10H12F9NO2/c1-20(2,5-6(21)22)4-3-7(11,12)8(13,14)9(15,16)10(17,18)19/h3-5H2,1-2H3

InChIKey

VQTNPRGLRDLXML-UHFFFAOYSA-N

Smiles

C[N+](C)(CCC(C(C(C(F)(F)F)(F)F)(F)F)(F)F)CC(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo intravenous 375mg/kg (375mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 27, Pg. 891, 1992.