ChemSpider 2D Image | 2-(2-{2-[3-(2,4-Dichlorophenoxy)-2-hydroxypropyl]-2H-tetrazol-5-yl}ethyl)-1H-isoindole-1,3(2H)-dione | C20H17Cl2N5O4

2-(2-{2-[3-(2,4-Dichlorophenoxy)-2-hydroxypropyl]-2H-tetrazol-5-yl}ethyl)-1H-isoindole-1,3(2H)-dione

  • Molecular FormulaC20H17Cl2N5O4
  • Average mass462.286 Da
  • Monoisotopic mass461.065765 Da
  • ChemSpider ID21733542

More details:

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

1H-Isoindole-1,3(2H)-dione, 2-[2-[2-[3-(2,4-dichlorophenoxy)-2-hydroxypropyl]-2H-tetrazol-5-yl]ethyl]- [ACD/Index Name]
2-(2-{2-[3-(2,4-Dichlorophenoxy)-2-hydroxypropyl]-2H-tetrazol-5-yl}ethyl)-1H-isoindole-1,3(2H)-dione [ACD/IUPAC Name]
2-(2-{2-[3-(2,4-Dichlorophénoxy)-2-hydroxypropyl]-2H-tétrazol-5-yl}éthyl)-1H-isoindole-1,3(2H)-dione [French] [ACD/IUPAC Name]
2-(2-{2-[3-(2,4-Dichlorphenoxy)-2-hydroxypropyl]-2H-tetrazol-5-yl}ethyl)-1H-isoindol-1,3(2H)-dion [German] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 694.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.9±3.0 kJ/mol
Flash Point: 374.0±34.3 °C
Index of Refraction: 1.712
Molar Refractivity: 114.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 3.66
ACD/BCF (pH 5.5): 357.23
ACD/KOC (pH 5.5): 2338.86
ACD/LogD (pH 7.4): 3.66
ACD/BCF (pH 7.4): 357.25
ACD/KOC (pH 7.4): 2338.95
Polar Surface Area: 110 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 64.1±7.0 dyne/cm
Molar Volume: 292.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement