ChemSpider 2D Image | N-(3-Iodo-4,5-dimethoxybenzyl)-2-propanamine | C12H18INO2

N-(3-Iodo-4,5-dimethoxybenzyl)-2-propanamine

  • Molecular FormulaC12H18INO2
  • Average mass335.181 Da
  • Monoisotopic mass335.038208 Da
  • ChemSpider ID57688058

More details:






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

Benzenemethanamine, 3-iodo-4,5-dimethoxy-N-(1-methylethyl)- [ACD/Index Name]
N-(3-Iod-4,5-dimethoxybenzyl)-2-propanamin [German] [ACD/IUPAC Name]
N-(3-Iodo-4,5-dimethoxybenzyl)-2-propanamine [ACD/IUPAC Name]
N-(3-Iodo-4,5-diméthoxybenzyl)-2-propanamine [French] [ACD/IUPAC Name]
1709020-22-3 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 362.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.9±3.0 kJ/mol
Flash Point: 173.3±27.9 °C
Index of Refraction: 1.552
Molar Refractivity: 74.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.06
ACD/LogD (pH 5.5): 0.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.23
ACD/LogD (pH 7.4): 1.49
ACD/BCF (pH 7.4): 3.40
ACD/KOC (pH 7.4): 30.37
Polar Surface Area: 30 Å2
Polarizability: 29.7±0.5 10-24cm3
Surface Tension: 36.8±3.0 dyne/cm
Molar Volume: 234.5±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement