Found 170 results

Search term: MF = 'C_{17}H_{14}Br_{2}N_{2}'
ChemSpider 2D Image | 5-Bromo-2-{[3-(3-bromophenyl)cyclobutyl]amino}benzonitrile | C17H14Br2N2

5-Bromo-2-{[3-(3-bromophenyl)cyclobutyl]amino}benzonitrile

  • Molecular FormulaC17H14Br2N2
  • Average mass406.115 Da
  • Monoisotopic mass403.952362 Da
  • ChemSpider ID40896591

More details:

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

5-Brom-2-{[3-(3-bromphenyl)cyclobutyl]amino}benzonitril [German] [ACD/IUPAC Name]
5-Bromo-2-{[3-(3-bromophenyl)cyclobutyl]amino}benzonitrile [ACD/IUPAC Name]
5-Bromo-2-{[3-(3-bromophényl)cyclobutyl]amino}benzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 5-bromo-2-[[3-(3-bromophenyl)cyclobutyl]amino]- [ACD/Index Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 500.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.9±3.0 kJ/mol
Flash Point: 256.4±30.1 °C
Index of Refraction: 1.683
Molar Refractivity: 91.6±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.43
ACD/LogD (pH 5.5): 5.40
ACD/BCF (pH 5.5): 7489.49
ACD/KOC (pH 5.5): 20648.57
ACD/LogD (pH 7.4): 5.40
ACD/BCF (pH 7.4): 7491.52
ACD/KOC (pH 7.4): 20654.17
Polar Surface Area: 36 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 63.8±5.0 dyne/cm
Molar Volume: 241.4±5.0 cm3

Click to predict properties on the Chemicalize site


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