ChemSpider 2D Image | [Dimethyl(3-{[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl]amino}propyl)ammonio]acetate | C15H19F13N2O4S

[Dimethyl(3-{[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl]amino}propyl)ammonio]acetate

  • Molecular FormulaC15H19F13N2O4S
  • Average mass570.367 Da
  • Monoisotopic mass570.085815 Da
  • ChemSpider ID106068

More details:






Validated by Experts, Validated by Users, Non-Validated, Removed by Users

[Dimethyl(3-{[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoroctyl)sulfonyl]amino}propyl)ammonio]acetat [German] [ACD/IUPAC Name]
[Dimethyl(3-{[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl]amino}propyl)ammonio]acetate [ACD/IUPAC Name]
[Diméthyl(3-{[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridécafluorooctyl)sulfonyl]amino}propyl)ammonio]acétate [French] [ACD/IUPAC Name]
1-Propanaminium, N-(carboxymethyl)-N,N-dimethyl-3-[[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl]amino]-, inner salt [ACD/Index Name]
N-(CARBOXYMETHYL)-N,N-DIMETHYL-3-(((3,3,4,4,5,5,6,6,7,7,8,8,8-TRIDECAFLUOROOCTYL)SULFONYL)AMINO)1-PROPANAMINIUM
N-(Carboxymethyl)-N,N-dimethyl-3-[[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl]amino]-1-propanaminium inner salt
N-(Carboxymethyl)-N,N-dimethyl-3-{[(3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl]amino}-1-propanaminium [ACD/IUPAC Name]
1-Propanaminium, N-(carboxymethyl)-N,N-dimethyl-3-(((3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl)amino)-, hydroxide, inner salt
1-Propanaminium, N-(carboxymethyl)-N,N-dimethyl-3-(((3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluorooctyl)sulfonyl)amino)-, inner salt
1-Propanaminium, N-(carboxymethyl)-N,N-dimethyl-3-((1,1,2,2-tetrahydroperfluorooctyl)sulfonylamino)-, hydroxide, inner salt
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

K7YO4672FB [DBID]
UNII:K7YO4672FB [DBID]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density:
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 0.47
ACD/LogD (pH 5.5): 0.59
ACD/BCF (pH 5.5): 2.30
ACD/KOC (pH 5.5): 93.66
ACD/LogD (pH 7.4): 0.59
ACD/BCF (pH 7.4): 2.30
ACD/KOC (pH 7.4): 93.39
Polar Surface Area: 95 Å2
Polarizability:
Surface Tension:
Molar Volume:

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