ChemSpider 2D Image | N-Ethylperfluorooctane sulfonamidoacetic acid | C12H8F17NO4S

N-Ethylperfluorooctane sulfonamidoacetic acid

  • Molecular FormulaC12H8F17NO4S
  • Average mass585.234 Da
  • Monoisotopic mass584.990234 Da
  • ChemSpider ID17128

More details:

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

2-(N-Ethylperfluorooctanesulfonamido)acetic acid
221-061-1 [EINECS]
2991-50-6 [RN]
Glycine, N-ethyl-N-[(1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-heptadecafluorooctyl)sulfonyl]- [ACD/Index Name]
N-ethyl-N-((heptadecafluorooctyl)sulfonyl)glycine
N-Ethyl-N-[(heptadecafluoroctyl)sulfonyl]glycin [German] [ACD/IUPAC Name]
N-Ethyl-N-[(heptadecafluorooctyl)sulfonyl]glycine [ACD/IUPAC Name]
N-Éthyl-N-[(heptadécafluorooctyl)sulfonyl]glycine [French] [ACD/IUPAC Name]
N-Ethylperfluorooctane sulfonamidoacetic acid
(N-ETHYL1,1,2,2,3,3,4,4,5,5,6,6,7,7,8,8,8-HEPTADECAFLUOROOCTANESULFONAMIDO)ACETIC ACID
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

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

Density: 1.7±0.1 g/cm3
Boiling Point: 343.4±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 64.5±6.0 kJ/mol
Flash Point: 161.5±30.7 °C
Index of Refraction: 1.352
Molar Refractivity: 74.1±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 9.34
ACD/LogD (pH 5.5): 4.17
ACD/BCF (pH 5.5): 212.38
ACD/KOC (pH 5.5): 304.74
ACD/LogD (pH 7.4): 3.04
ACD/BCF (pH 7.4): 15.77
ACD/KOC (pH 7.4): 22.63
Polar Surface Area: 83 Å2
Polarizability: 29.4±0.5 10-24cm3
Surface Tension: 24.6±3.0 dyne/cm
Molar Volume: 342.5±3.0 cm3

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