ChemSpider 2D Image | (4Z)-2-(4-Bromophenyl)-4-(1H-indol-3-ylmethylene)-1,3-oxazol-5(4H)-one | C18H11BrN2O2

(4Z)-2-(4-Bromophenyl)-4-(1H-indol-3-ylmethylene)-1,3-oxazol-5(4H)-one

  • Molecular FormulaC18H11BrN2O2
  • Average mass367.196 Da
  • Monoisotopic mass366.000397 Da
  • ChemSpider ID23009341

  • Double-bond stereo - Double-bond stereo

More details:

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

(4Z)-2-(4-Bromophenyl)-4-(1H-indol-3-ylmethylene)-1,3-oxazol-5(4H)-one [ACD/IUPAC Name]
(4Z)-2-(4-Bromophényl)-4-(1H-indol-3-ylméthylène)-1,3-oxazol-5(4H)-one [French] [ACD/IUPAC Name]
(4Z)-2-(4-Bromphenyl)-4-(1H-indol-3-ylmethylen)-1,3-oxazol-5(4H)-on [German] [ACD/IUPAC Name]
5(4H)-Oxazolone, 2-(4-bromophenyl)-4-(1H-indol-3-ylmethylene)-, (4Z)- [ACD/Index Name]
(4Z)-2-(4-BROMOPHENYL)-4-(1H-INDOL-3-YLMETHYLIDENE)-1,3-OXAZOL-5-ONE

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

Density: 1.6±0.1 g/cm3
Boiling Point: 535.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 277.5±32.9 °C
Index of Refraction: 1.708
Molar Refractivity: 91.2±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.58
ACD/LogD (pH 5.5): 3.99
ACD/BCF (pH 5.5): 636.52
ACD/KOC (pH 5.5): 3536.31
ACD/LogD (pH 7.4): 3.99
ACD/BCF (pH 7.4): 636.64
ACD/KOC (pH 7.4): 3536.94
Polar Surface Area: 54 Å2
Polarizability: 36.2±0.5 10-24cm3
Surface Tension: 55.2±7.0 dyne/cm
Molar Volume: 234.0±7.0 cm3

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