ChemSpider 2D Image | 2-(4-iodo-2,5-dimethoxyphenyl)-N-[(2-fluorophenyl)methyl]ethanamine | C17H19FINO2

2-(4-iodo-2,5-dimethoxyphenyl)-N-[(2-fluorophenyl)methyl]ethanamine

  • Molecular FormulaC17H19FINO2
  • Average mass415.241 Da
  • Monoisotopic mass415.044434 Da
  • ChemSpider ID24751866

More details:

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

2-(4-iodo-2,5-dimethoxyphenyl)-N-[(2-fluorophenyl)methyl]ethanamine
25I-NBF [Wiki]
Benzeneethanamine, N-[(2-fluorophenyl)methyl]-4-iodo-2,5-dimethoxy- [ACD/Index Name]
N-(2-Fluorbenzyl)-2-(4-iod-2,5-dimethoxyphenyl)ethanamin [German] [ACD/IUPAC Name]
N-(2-Fluorobenzyl)-2-(4-iodo-2,5-dimethoxyphenyl)ethanamine [ACD/IUPAC Name]
N-(2-Fluorobenzyl)-2-(4-iodo-2,5-diméthoxyphényl)éthanamine [French] [ACD/IUPAC Name]
25I-NBF N-(2-fluorbenzyl)-2-(4-jod-2,5-dimethoxyphenyl)ethanamine [ACD/IUPAC Name]
919797-21-0 [RN]
N-[(2-Fluorophenyl)methyl]-2-(4-iodo-2,5-dimethoxyphenyl)ethan-1-amine

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

Density: 1.5±0.1 g/cm3
Boiling Point: 456.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.7±3.0 kJ/mol
Flash Point: 230.1±28.7 °C
Index of Refraction: 1.586
Molar Refractivity: 94.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 2.08
ACD/BCF (pH 5.5): 5.35
ACD/KOC (pH 5.5): 21.04
ACD/LogD (pH 7.4): 3.77
ACD/BCF (pH 7.4): 257.19
ACD/KOC (pH 7.4): 1011.25
Polar Surface Area: 30 Å2
Polarizability: 37.6±0.5 10-24cm3
Surface Tension: 42.1±3.0 dyne/cm
Molar Volume: 282.6±3.0 cm3

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