ChemSpider 2D Image | (3-Iodo-5-nitrophenyl){1-[(1-methyl-2-piperidinyl)methyl]-1H-indol-3-yl}methanone | C22H22IN3O3

(3-Iodo-5-nitrophenyl){1-[(1-methyl-2-piperidinyl)methyl]-1H-indol-3-yl}methanone

  • Molecular FormulaC22H22IN3O3
  • Average mass503.333 Da
  • Monoisotopic mass503.070587 Da
  • ChemSpider ID8293492

More details:

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

(3-Iod-5-nitrophenyl){1-[(1-methyl-2-piperidinyl)methyl]-1H-indol-3-yl}methanon [German] [ACD/IUPAC Name]
(3-Iodo-5-nitrophenyl){1-[(1-methyl-2-piperidinyl)methyl]-1H-indol-3-yl}methanone [ACD/IUPAC Name]
(3-Iodo-5-nitrophényl){1-[(1-méthyl-2-pipéridinyl)méthyl]-1H-indol-3-yl}méthanone [French] [ACD/IUPAC Name]
Methanone, (3-iodo-5-nitrophenyl)[1-[(1-methyl-2-piperidinyl)methyl]-1H-indol-3-yl]- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 618.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 327.8±30.1 °C
Index of Refraction: 1.696
Molar Refractivity: 120.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.44
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 4.18
ACD/KOC (pH 5.5): 13.01
ACD/LogD (pH 7.4): 2.89
ACD/BCF (pH 7.4): 26.75
ACD/KOC (pH 7.4): 83.22
Polar Surface Area: 71 Å2
Polarizability: 47.8±0.5 10-24cm3
Surface Tension: 56.4±7.0 dyne/cm
Molar Volume: 313.5±7.0 cm3

Click to predict properties on the Chemicalize site


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