ChemSpider 2D Image | N-Ethyl-2-(4-iodobenzyl)-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrrol-4-amine | C18H23IN2

N-Ethyl-2-(4-iodobenzyl)-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrrol-4-amine

  • Molecular FormulaC18H23IN2
  • Average mass394.293 Da
  • Monoisotopic mass394.090576 Da
  • ChemSpider ID40888532

More details:

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

Cyclohepta[c]pyrrol-4-amine, N-ethyl-2,4,5,6,7,8-hexahydro-2-[(4-iodophenyl)methyl]- [ACD/Index Name]
N-Ethyl-2-(4-iodbenzyl)-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrrol-4-amin [German] [ACD/IUPAC Name]
N-Ethyl-2-(4-iodobenzyl)-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrrol-4-amine [ACD/IUPAC Name]
N-Éthyl-2-(4-iodobenzyl)-2,4,5,6,7,8-hexahydrocyclohepta[c]pyrrol-4-amine [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 458.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.9±3.0 kJ/mol
Flash Point: 231.3±28.7 °C
Index of Refraction: 1.643
Molar Refractivity: 97.3±0.5 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.03
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 2.16
ACD/KOC (pH 5.5): 7.98
ACD/LogD (pH 7.4): 2.06
ACD/BCF (pH 7.4): 4.77
ACD/KOC (pH 7.4): 17.60
Polar Surface Area: 17 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 44.3±7.0 dyne/cm
Molar Volume: 269.1±7.0 cm3

Click to predict properties on the Chemicalize site


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