ChemSpider 2D Image | 3-(Benzyloxy)-4-bromobenzonitrile | C14H10BrNO

3-(Benzyloxy)-4-bromobenzonitrile

  • Molecular FormulaC14H10BrNO
  • Average mass288.139 Da
  • Monoisotopic mass286.994568 Da
  • ChemSpider ID30648431

More details:

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

3-(Benzyloxy)-4-brombenzonitril [German] [ACD/IUPAC Name]
3-(Benzyloxy)-4-bromobenzonitrile [ACD/IUPAC Name]
3-(Benzyloxy)-4-bromobenzonitrile [French] [ACD/IUPAC Name]
Benzonitrile, 4-bromo-3-(phenylmethoxy)- [ACD/Index Name]
693232-05-2 [RN]
MFCD27923602

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

Density: 1.5±0.1 g/cm3
Boiling Point: 385.8±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 63.5±3.0 kJ/mol
Flash Point: 187.1±25.1 °C
Index of Refraction: 1.635
Molar Refractivity: 70.1±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.67
ACD/LogD (pH 5.5): 4.06
ACD/BCF (pH 5.5): 718.93
ACD/KOC (pH 5.5): 3858.49
ACD/LogD (pH 7.4): 4.06
ACD/BCF (pH 7.4): 718.93
ACD/KOC (pH 7.4): 3858.49
Polar Surface Area: 33 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 56.4±5.0 dyne/cm
Molar Volume: 195.8±5.0 cm3

Click to predict properties on the Chemicalize site


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