ChemSpider 2D Image | 2,2-Difluoro-2-(1H-pyrrol-2-yl)ethanamine | C6H8F2N2

2,2-Difluoro-2-(1H-pyrrol-2-yl)ethanamine

  • Molecular FormulaC6H8F2N2
  • Average mass146.138 Da
  • Monoisotopic mass146.065552 Da
  • ChemSpider ID58601356

More details:






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

1H-Pyrrole-2-ethanamine, β,β-difluoro- [ACD/Index Name]
2,2-Difluor-2-(1H-pyrrol-2-yl)ethanamin [German] [ACD/IUPAC Name]
2,2-Difluoro-2-(1H-pyrrol-2-yl)ethanamine [ACD/IUPAC Name]
2,2-Difluoro-2-(1H-pyrrol-2-yl)éthanamine [French] [ACD/IUPAC Name]
1782878-53-8 [RN]
2,2-difluoro-2-(1H-pyrrol-2-yl)ethan-1-amine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 281.1±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.0±3.0 kJ/mol
Flash Point: 123.8±25.9 °C
Index of Refraction: 1.492
Molar Refractivity: 33.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.63
ACD/LogD (pH 5.5): -0.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.63
ACD/LogD (pH 7.4): 0.62
ACD/BCF (pH 7.4): 1.66
ACD/KOC (pH 7.4): 47.74
Polar Surface Area: 42 Å2
Polarizability: 13.3±0.5 10-24cm3
Surface Tension: 35.6±3.0 dyne/cm
Molar Volume: 116.0±3.0 cm3

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