ChemSpider 2D Image | 4-{[(4-Fluoro-2-methylphenyl)amino]methyl}benzonitrile | C15H13FN2

4-{[(4-Fluoro-2-methylphenyl)amino]methyl}benzonitrile

  • Molecular FormulaC15H13FN2
  • Average mass240.275 Da
  • Monoisotopic mass240.106277 Da
  • ChemSpider ID24046336

More details:

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

4-{[(4-Fluor-2-methylphenyl)amino]methyl}benzonitril [German] [ACD/IUPAC Name]
4-{[(4-Fluoro-2-methylphenyl)amino]methyl}benzonitrile [ACD/IUPAC Name]
4-{[(4-Fluoro-2-méthylphényl)amino]méthyl}benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4-[[(4-fluoro-2-methylphenyl)amino]methyl]- [ACD/Index Name]
1021080-21-6 [RN]
MFCD11146552 [MDL number]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 395.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.6±3.0 kJ/mol
Flash Point: 193.1±27.9 °C
Index of Refraction: 1.589
Molar Refractivity: 69.0±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.47
ACD/LogD (pH 5.5): 3.29
ACD/BCF (pH 5.5): 185.82
ACD/KOC (pH 5.5): 1463.71
ACD/LogD (pH 7.4): 3.29
ACD/BCF (pH 7.4): 186.35
ACD/KOC (pH 7.4): 1467.95
Polar Surface Area: 36 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 47.9±5.0 dyne/cm
Molar Volume: 204.9±5.0 cm3

Click to predict properties on the Chemicalize site


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