ChemSpider 2D Image | N-Benzyl-1-(4-iodo-2,5-dimethoxyphenyl)-2-propanamine | C18H22INO2

N-Benzyl-1-(4-iodo-2,5-dimethoxyphenyl)-2-propanamine

  • Molecular FormulaC18H22INO2
  • Average mass411.277 Da
  • Monoisotopic mass411.069519 Da
  • ChemSpider ID23110813

More details:

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

Benzeneethanamine, 4-iodo-2,5-dimethoxy-α-methyl-N-(phenylmethyl)- [ACD/Index Name]
N-Benzyl-1-(4-iod-2,5-dimethoxyphenyl)-2-propanamin [German] [ACD/IUPAC Name]
N-Benzyl-1-(4-iodo-2,5-dimethoxyphenyl)-2-propanamine [ACD/IUPAC Name]
N-Benzyl-1-(4-iodo-2,5-diméthoxyphényl)-2-propanamine [French] [ACD/IUPAC Name]
Benzyl-[2-(4-iodo-2,5-dimethoxy-phenyl)-1-methyl-ethyl]-amine
N-benzyl-1-(4-iodo-2,5-dimethoxyphenyl)propan-2-amine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 463.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.4±3.0 kJ/mol
Flash Point: 233.9±28.7 °C
Index of Refraction: 1.588
Molar Refractivity: 99.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.73
ACD/LogD (pH 5.5): 2.02
ACD/BCF (pH 5.5): 3.91
ACD/KOC (pH 5.5): 13.28
ACD/LogD (pH 7.4): 3.35
ACD/BCF (pH 7.4): 84.13
ACD/KOC (pH 7.4): 285.40
Polar Surface Area: 30 Å2
Polarizability: 39.4±0.5 10-24cm3
Surface Tension: 41.6±3.0 dyne/cm
Molar Volume: 295.2±3.0 cm3

Click to predict properties on the Chemicalize site


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