ChemSpider 2D Image | 5-Bromo-2-[4-(dimethylamino)-1-piperidinyl]benzonitrile | C14H18BrN3

5-Bromo-2-[4-(dimethylamino)-1-piperidinyl]benzonitrile

  • Molecular FormulaC14H18BrN3
  • Average mass308.217 Da
  • Monoisotopic mass307.068390 Da
  • ChemSpider ID32056837

More details:

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

5-Brom-2-[4-(dimethylamino)-1-piperidinyl]benzonitril [German] [ACD/IUPAC Name]
5-Bromo-2-[4-(dimethylamino)-1-piperidinyl]benzonitrile [ACD/IUPAC Name]
5-Bromo-2-[4-(diméthylamino)-1-pipéridinyl]benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 5-bromo-2-[4-(dimethylamino)-1-piperidinyl]- [ACD/Index Name]
1260891-15-3 [RN]
5-Bromo-2-(4-(dimethylamino)piperidin-1-yl)benzonitrile
5-Bromo-2-(4-(dimethylamino)-piperidin-1-yl)benzonitrile
5-bromo-2-[4-(dimethylamino)piperidin-1-yl]benzonitrile
MFCD11037643 [MDL number]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 415.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.9±3.0 kJ/mol
Flash Point: 205.4±28.7 °C
Index of Refraction: 1.610
Molar Refractivity: 77.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.02
ACD/LogD (pH 5.5): -0.32
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.37
Polar Surface Area: 30 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 54.2±5.0 dyne/cm
Molar Volume: 222.6±5.0 cm3

Click to predict properties on the Chemicalize site


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