ChemSpider 2D Image | N-[1-Benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-4-(2-methyl-2-propanyl)benzamide | C29H31F3N2O3

N-[1-Benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-4-(2-methyl-2-propanyl)benzamide

  • Molecular FormulaC29H31F3N2O3
  • Average mass512.563 Da
  • Monoisotopic mass512.228699 Da
  • ChemSpider ID4097940

More details:

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

Benzamide, 4-(1,1-dimethylethyl)-N-[2,3,4,5,6,7-hexahydro-6,6-dimethyl-2,4-dioxo-1-(phenylmethyl)-3-(trifluoromethyl)-1H-indol-3-yl]- [ACD/Index Name]
N-[1-Benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluormethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-4-(2-methyl-2-propanyl)benzamid [German] [ACD/IUPAC Name]
N-[1-Benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-4-(2-methyl-2-propanyl)benzamide [ACD/IUPAC Name]
N-[1-Benzyl-6,6-diméthyl-2,4-dioxo-3-(trifluorométhyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-4-(2-méthyl-2-propanyl)benzamide [French] [ACD/IUPAC Name]
N-(1-Benzyl-6,6-dimethyl-2,4-dioxo-3-trifluoromethyl-2,3,4,5,6,7-hexahydro-1H-indol-3-yl)-4-tert-butyl-benzamide
N-[1-benzyl-6,6-dimethyl-2,4-dioxo-3-(trifluoromethyl)-2,3,4,5,6,7-hexahydro-1H-indol-3-yl]-4-tert-butylbenzamide
N-[6,6-dimethyl-2,4-dioxo-1-benzyl-3-(trifluoromethyl)(3,5,6,7-tetrahydroindol-3-yl)][4-(tert-butyl)phenyl]carboxamide

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

A3448/0146414 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 646.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.4±3.0 kJ/mol
Flash Point: 344.9±31.5 °C
Index of Refraction: 1.579
Molar Refractivity: 133.8±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 8.88
ACD/LogD (pH 5.5): 6.31
ACD/BCF (pH 5.5): 36961.25
ACD/KOC (pH 5.5): 64733.14
ACD/LogD (pH 7.4): 6.30
ACD/BCF (pH 7.4): 35825.05
ACD/KOC (pH 7.4): 62743.23
Polar Surface Area: 66 Å2
Polarizability: 53.0±0.5 10-24cm3
Surface Tension: 48.3±5.0 dyne/cm
Molar Volume: 402.4±5.0 cm3

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