ChemSpider 2D Image | 4-(2-Aminopropyl)-2,5-dimethoxybenzonitrile | C12H16N2O2

4-(2-Aminopropyl)-2,5-dimethoxybenzonitrile

  • Molecular FormulaC12H16N2O2
  • Average mass220.268 Da
  • Monoisotopic mass220.121185 Da
  • ChemSpider ID23108720

More details:

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

4-(2-Aminopropyl)-2,5-dimethoxybenzonitril [German] [ACD/IUPAC Name]
4-(2-Aminopropyl)-2,5-dimethoxybenzonitrile [ACD/IUPAC Name]
4-(2-Aminopropyl)-2,5-diméthoxybenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4-(2-aminopropyl)-2,5-dimethoxy- [ACD/Index Name]
125903-74-4 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 372.6±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.0±3.0 kJ/mol
Flash Point: 179.1±27.9 °C
Index of Refraction: 1.534
Molar Refractivity: 61.5±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 1.30
ACD/LogD (pH 5.5): -1.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.20
Polar Surface Area: 68 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 46.2±5.0 dyne/cm
Molar Volume: 198.0±5.0 cm3

Click to predict properties on the Chemicalize site


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