ChemSpider 2D Image | 3-(3-methoxybenzyl)-1H-pyrrolo[2,3-b]pyridine | C15H14N2O

3-(3-methoxybenzyl)-1H-pyrrolo[2,3-b]pyridine

  • Molecular FormulaC15H14N2O
  • Average mass238.285 Da
  • Monoisotopic mass238.110611 Da
  • ChemSpider ID22376728

More details:

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

3-(3-methoxybenzyl)-1H-pyrrolo[2,3-b]pyridine
3-[(3-methoxyphenyl)methyl]-1H-pyrrolo[2,3-b]pyridine
C4F

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

Density: 1.2±0.1 g/cm3
Boiling Point: 430.6±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.0±3.0 kJ/mol
Flash Point: 142.4±15.6 °C
Index of Refraction: 1.652
Molar Refractivity: 72.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.72
ACD/LogD (pH 5.5): 3.45
ACD/BCF (pH 5.5): 226.80
ACD/KOC (pH 5.5): 1521.00
ACD/LogD (pH 7.4): 3.61
ACD/BCF (pH 7.4): 326.46
ACD/KOC (pH 7.4): 2189.32
Polar Surface Area: 38 Å2
Polarizability: 28.8±0.5 10-24cm3
Surface Tension: 51.8±3.0 dyne/cm
Molar Volume: 198.5±3.0 cm3

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