ChemSpider 2D Image | 2-[(2-Fluorophenyl)amino]-2,3-dimethylbutanenitrile | C12H15FN2

2-[(2-Fluorophenyl)amino]-2,3-dimethylbutanenitrile

  • Molecular FormulaC12H15FN2
  • Average mass206.259 Da
  • Monoisotopic mass206.121933 Da
  • ChemSpider ID25999795

More details:

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

2-[(2-Fluorophenyl)amino]-2,3-dimethylbutanenitrile [ACD/IUPAC Name]
2-[(2-Fluorophényl)amino]-2,3-diméthylbutanenitrile [French] [ACD/IUPAC Name]
2-[(2-Fluorphenyl)amino]-2,3-dimethylbutannitril [German] [ACD/IUPAC Name]
Butanenitrile, 2-[(2-fluorophenyl)amino]-2,3-dimethyl- [ACD/Index Name]
1184043-31-9 [RN]
MFCD12816901 [MDL number]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 325.9±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.8±3.0 kJ/mol
Flash Point: 150.9±23.7 °C
Index of Refraction: 1.534
Molar Refractivity: 58.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.60
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 101.31
ACD/KOC (pH 5.5): 948.94
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 101.31
ACD/KOC (pH 7.4): 948.96
Polar Surface Area: 36 Å2
Polarizability: 23.3±0.5 10-24cm3
Surface Tension: 38.9±3.0 dyne/cm
Molar Volume: 189.4±3.0 cm3

Click to predict properties on the Chemicalize site


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