ChemSpider 2D Image | 2-{4-(5-Chloro-2,3-dimethoxybenzyl)-1-[(5-methyl-2-furyl)methyl]-2-piperazinyl}ethanol | C21H29ClN2O4

2-{4-(5-Chloro-2,3-dimethoxybenzyl)-1-[(5-methyl-2-furyl)methyl]-2-piperazinyl}ethanol

  • Molecular FormulaC21H29ClN2O4
  • Average mass408.919 Da
  • Monoisotopic mass408.181580 Da
  • ChemSpider ID22247823

More details:

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

2-{4-(5-Chlor-2,3-dimethoxybenzyl)-1-[(5-methyl-2-furyl)methyl]-2-piperazinyl}ethanol [German] [ACD/IUPAC Name]
2-{4-(5-Chloro-2,3-dimethoxybenzyl)-1-[(5-methyl-2-furyl)methyl]-2-piperazinyl}ethanol [ACD/IUPAC Name]
2-{4-(5-Chloro-2,3-diméthoxybenzyl)-1-[(5-méthyl-2-furyl)méthyl]-2-pipérazinyl}éthanol [French] [ACD/IUPAC Name]
2-Piperazineethanol, 4-[(5-chloro-2,3-dimethoxyphenyl)methyl]-1-[(5-methyl-2-furanyl)methyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 503.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.4±3.0 kJ/mol
Flash Point: 258.4±28.7 °C
Index of Refraction: 1.563
Molar Refractivity: 110.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.21
ACD/LogD (pH 5.5): 1.38
ACD/BCF (pH 5.5): 3.38
ACD/KOC (pH 5.5): 38.25
ACD/LogD (pH 7.4): 2.49
ACD/BCF (pH 7.4): 44.23
ACD/KOC (pH 7.4): 499.73
Polar Surface Area: 58 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 339.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement