ChemSpider 2D Image | N-(Trifluoroacetyl)-alpha-L-gulopyranosylamine | C8H12F3NO6

N-(Trifluoroacetyl)-α-L-gulopyranosylamine

  • Molecular FormulaC8H12F3NO6
  • Average mass275.179 Da
  • Monoisotopic mass275.061676 Da
  • ChemSpider ID58131199

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

N-(2,2,2-Trifluoroacétyl)-α-L-gulopyranosylamine [French] [ACD/IUPAC Name]
N-(Trifluoracetyl)-α-L-gulopyranosylamin [German] [ACD/IUPAC Name]
N-(Trifluoroacetyl)-α-L-gulopyranosylamine [ACD/IUPAC Name]
α-L-Gulopyranosylamine, N-(2,2,2-trifluoroacetyl)- [ACD/Index Name]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL3349654/

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

Density: 1.7±0.1 g/cm3
Boiling Point: 486.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 86.6±6.0 kJ/mol
Flash Point: 247.8±28.7 °C
Index of Refraction: 1.514
Molar Refractivity: 48.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: -0.10
ACD/LogD (pH 5.5): -0.85
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.17
ACD/LogD (pH 7.4): -0.88
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.63
Polar Surface Area: 119 Å2
Polarizability: 19.4±0.5 10-24cm3
Surface Tension: 61.9±5.0 dyne/cm
Molar Volume: 162.6±5.0 cm3

Click to predict properties on the Chemicalize site


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