ChemSpider 2D Image | 3-Iodo-N-{3-[4-(3-methylphenyl)-1-piperazinyl]propyl}benzamide | C21H26IN3O

3-Iodo-N-{3-[4-(3-methylphenyl)-1-piperazinyl]propyl}benzamide

  • Molecular FormulaC21H26IN3O
  • Average mass463.355 Da
  • Monoisotopic mass463.112061 Da
  • ChemSpider ID33701235

More details:

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

3-Iod-N-{3-[4-(3-methylphenyl)-1-piperazinyl]propyl}benzamid [German] [ACD/IUPAC Name]
3-Iodo-N-{3-[4-(3-methylphenyl)-1-piperazinyl]propyl}benzamide [ACD/IUPAC Name]
3-Iodo-N-{3-[4-(3-méthylphényl)-1-pipérazinyl]propyl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 3-iodo-N-[3-[4-(3-methylphenyl)-1-piperazinyl]propyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 595.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.7±3.0 kJ/mol
Flash Point: 313.8±30.1 °C
Index of Refraction: 1.613
Molar Refractivity: 114.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.73
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 14.05
ACD/KOC (pH 5.5): 70.89
ACD/LogD (pH 7.4): 3.92
ACD/BCF (pH 7.4): 486.12
ACD/KOC (pH 7.4): 2451.95
Polar Surface Area: 36 Å2
Polarizability: 45.6±0.5 10-24cm3
Surface Tension: 47.7±3.0 dyne/cm
Molar Volume: 329.9±3.0 cm3

Click to predict properties on the Chemicalize site


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