ChemSpider 2D Image | (2Z)-2-(4-Bromophenyl)-3-(4-iodophenyl)acrylonitrile | C15H9BrIN

(2Z)-2-(4-Bromophenyl)-3-(4-iodophenyl)acrylonitrile

  • Molecular FormulaC15H9BrIN
  • Average mass410.047 Da
  • Monoisotopic mass408.896301 Da
  • ChemSpider ID26994611

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-(4-Bromophenyl)-3-(4-iodophenyl)acrylonitrile [ACD/IUPAC Name]
(2Z)-2-(4-Bromophényl)-3-(4-iodophényl)acrylonitrile [French] [ACD/IUPAC Name]
(2Z)-2-(4-Bromphenyl)-3-(4-iodphenyl)acrylonitril [German] [ACD/IUPAC Name]
Benzeneacetonitrile, 4-bromo-α-[(4-iodophenyl)methylene]-, (αZ)- [ACD/Index Name]
(Z)-2-(4-Bromophenyl)-3-(4-iodophenyl)acrylonitrile

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

Density: 1.8±0.1 g/cm3
Boiling Point: 448.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.7±3.0 kJ/mol
Flash Point: 225.3±28.7 °C
Index of Refraction: 1.708
Molar Refractivity: 87.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.41
ACD/LogD (pH 5.5): 5.68
ACD/BCF (pH 5.5): 12248.55
ACD/KOC (pH 5.5): 29365.66
ACD/LogD (pH 7.4): 5.68
ACD/BCF (pH 7.4): 12248.55
ACD/KOC (pH 7.4): 29365.66
Polar Surface Area: 24 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 57.2±3.0 dyne/cm
Molar Volume: 224.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement