ChemSpider 2D Image | 2-(6,7-Dimethoxy-1,3-benzodioxol-5-yl)ethanamine | C11H15NO4

2-(6,7-Dimethoxy-1,3-benzodioxol-5-yl)ethanamine

  • Molecular FormulaC11H15NO4
  • Average mass225.241 Da
  • Monoisotopic mass225.100113 Da
  • ChemSpider ID62914183

More details:






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

1,3-Benzodioxole-5-ethanamine, 6,7-dimethoxy- [ACD/Index Name]
2-(6,7-Dimethoxy-1,3-benzodioxol-5-yl)ethanamin [German] [ACD/IUPAC Name]
2-(6,7-Dimethoxy-1,3-benzodioxol-5-yl)ethanamine [ACD/IUPAC Name]
2-(6,7-Diméthoxy-1,3-benzodioxol-5-yl)éthanamine [French] [ACD/IUPAC Name]
33542-95-9 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 316.6±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.8±3.0 kJ/mol
Flash Point: 151.4±20.2 °C
Index of Refraction: 1.549
Molar Refractivity: 58.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.31
ACD/LogD (pH 5.5): -2.08
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.01
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 63 Å2
Polarizability: 23.3±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 185.1±3.0 cm3

Click to predict properties on the Chemicalize site






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