ChemSpider 2D Image | (Dimethylamino)(2-fluorophenyl)acetonitrile | C10H11FN2

(Dimethylamino)(2-fluorophenyl)acetonitrile

  • Molecular FormulaC10H11FN2
  • Average mass178.206 Da
  • Monoisotopic mass178.090622 Da
  • ChemSpider ID21919810

More details:

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

(Dimethylamino)(2-fluorophenyl)acetonitrile [ACD/IUPAC Name]
(Diméthylamino)(2-fluorophényl)acétonitrile [French] [ACD/IUPAC Name]
(Dimethylamino)(2-fluorphenyl)acetonitril [German] [ACD/IUPAC Name]
1017450-89-3 [RN]
2-(dimethylamino)-2-(2-fluorophenyl)acetonitrile
Benzeneacetonitrile, α-(dimethylamino)-2-fluoro- [ACD/Index Name]
(α-2-Fluorophenyl)(α-N,N-dimethylamino)acetonitrile
MFCD10005115 [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: 235.3±25.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 47.2±3.0 kJ/mol
Flash Point: 96.1±23.2 °C
Index of Refraction: 1.517
Molar Refractivity: 48.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.83
ACD/LogD (pH 5.5): 1.60
ACD/BCF (pH 5.5): 9.64
ACD/KOC (pH 5.5): 175.37
ACD/LogD (pH 7.4): 1.61
ACD/BCF (pH 7.4): 9.80
ACD/KOC (pH 7.4): 178.30
Polar Surface Area: 27 Å2
Polarizability: 19.3±0.5 10-24cm3
Surface Tension: 39.5±3.0 dyne/cm
Molar Volume: 160.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement