Found 4484 results

Search term: MF = 'C_{12}H_{14}BrN_{3}'
ChemSpider 2D Image | 2-Bromo-6-(1-piperidinylamino)benzonitrile | C12H14BrN3

2-Bromo-6-(1-piperidinylamino)benzonitrile

  • Molecular FormulaC12H14BrN3
  • Average mass280.164 Da
  • Monoisotopic mass279.037109 Da
  • ChemSpider ID29279960

More details:

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

1602288-43-6 [RN]
2-Brom-6-(1-piperidinylamino)benzonitril [German] [ACD/IUPAC Name]
2-Bromo-6-(1-piperidinylamino)benzonitrile [ACD/IUPAC Name]
2-Bromo-6-(1-pipéridinylamino)benzonitrile [French] [ACD/IUPAC Name]
2-BROMO-6-[(PIPERIDIN-1-YL)AMINO]BENZONITRILE
Benzonitrile, 2-bromo-6-(1-piperidinylamino)- [ACD/Index Name]
2-bromo-6-(piperidin-1-ylamino)benzonitrile
MFCD28013930 [MDL number]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 390.2±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.0±3.0 kJ/mol
Flash Point: 189.8±30.7 °C
Index of Refraction: 1.629
Molar Refractivity: 67.7±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.74
ACD/LogD (pH 5.5): 2.54
ACD/BCF (pH 5.5): 42.10
ACD/KOC (pH 5.5): 410.23
ACD/LogD (pH 7.4): 2.86
ACD/BCF (pH 7.4): 86.96
ACD/KOC (pH 7.4): 847.40
Polar Surface Area: 39 Å2
Polarizability: 26.8±0.5 10-24cm3
Surface Tension: 58.9±5.0 dyne/cm
Molar Volume: 190.5±5.0 cm3

Click to predict properties on the Chemicalize site


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