ChemSpider 2D Image | (2-Iodophenyl)[1-(1-methyl-3-azepanyl)-1H-indol-3-yl]methanone | C22H23IN2O

(2-Iodophenyl)[1-(1-methyl-3-azepanyl)-1H-indol-3-yl]methanone

  • Molecular FormulaC22H23IN2O
  • Average mass458.335 Da
  • Monoisotopic mass458.085510 Da
  • ChemSpider ID29341488

More details:






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

(2-Iodophenyl)[1-(1-methyl-3-azepanyl)-1H-indol-3-yl]methanone [ACD/IUPAC Name]
(2-Iodophényl)[1-(1-méthyl-3-azépanyl)-1H-indol-3-yl]méthanone [French] [ACD/IUPAC Name]
(2-Iodphenyl)[1-(1-methyl-3-azepanyl)-1H-indol-3-yl]methanon [German] [ACD/IUPAC Name]
Methanone, [1-(hexahydro-1-methyl-1H-azepin-3-yl)-1H-indol-3-yl](2-iodophenyl)- [ACD/Index Name]
(2-iodophenyl)(1-(1-methylazepan-3-yl)-1H-indol-3-yl)methanone
(2-iodophenyl)[1-(1-methylazepan-3-yl)-1h-indol-3-yl]methanone
(2-iodophenyl)-[1-(1-methylazepan-3-yl)indol-3-yl]methanone
1432478-91-5 [RN]
3-(2-IODOBENZOYL)-1-(1-METHYLAZEPAN-3-YL)-1H-INDOLE
3-(2-IODOBENZOYL)-1-(1-METHYLAZEPAN-3-YL)INDOLE
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 577.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.5±3.0 kJ/mol
Flash Point: 303.2±30.1 °C
Index of Refraction: 1.669
Molar Refractivity: 115.0±0.5 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 1.97
ACD/BCF (pH 5.5): 3.47
ACD/KOC (pH 5.5): 11.73
ACD/LogD (pH 7.4): 3.10
ACD/BCF (pH 7.4): 46.53
ACD/KOC (pH 7.4): 157.06
Polar Surface Area: 25 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 48.6±7.0 dyne/cm
Molar Volume: 308.2±7.0 cm3

Click to predict properties on the Chemicalize site






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