ChemSpider 2D Image | (4-Bromo-1H-pyrrol-2-yl)[4-(2-hydroxyethyl)-1-piperazinyl]methanone | C11H16BrN3O2

(4-Bromo-1H-pyrrol-2-yl)[4-(2-hydroxyethyl)-1-piperazinyl]methanone

  • Molecular FormulaC11H16BrN3O2
  • Average mass302.168 Da
  • Monoisotopic mass301.042572 Da
  • ChemSpider ID29837750

More details:

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

(4-Brom-1H-pyrrol-2-yl)[4-(2-hydroxyethyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
(4-Bromo-1H-pyrrol-2-yl)[4-(2-hydroxyethyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
(4-Bromo-1H-pyrrol-2-yl)[4-(2-hydroxyéthyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, (4-bromo-1H-pyrrol-2-yl)[4-(2-hydroxyethyl)-1-piperazinyl]- [ACD/Index Name]
2-[4-(4-bromo-1H-pyrrole-2-carbonyl)piperazin-1-yl]ethan-1-ol
2-[4-(4-BROMO-1H-PYRROLE-2-CARBONYL)PIPERAZIN-1-YL]ETHANOL

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

Density: 1.5±0.1 g/cm3
Boiling Point: 510.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.3±3.0 kJ/mol
Flash Point: 262.8±30.1 °C
Index of Refraction: 1.616
Molar Refractivity: 68.2±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: -0.78
ACD/LogD (pH 5.5): -0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.25
ACD/LogD (pH 7.4): 0.11
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 26.87
Polar Surface Area: 60 Å2
Polarizability: 27.0±0.5 10-24cm3
Surface Tension: 59.4±3.0 dyne/cm
Molar Volume: 195.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement