ChemSpider 2D Image | (3S)-Spiro[indole-3,3'-pyrrolidin]-2(1H)-one | C11H12N2O

(3S)-Spiro[indole-3,3'-pyrrolidin]-2(1H)-one

  • Molecular FormulaC11H12N2O
  • Average mass188.226 Da
  • Monoisotopic mass188.094955 Da
  • ChemSpider ID28666801

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-Spiro[indole-3,3'-pyrrolidin]-2(1H)-on [German] [ACD/IUPAC Name]
(3S)-Spiro[indole-3,3'-pyrrolidin]-2(1H)-one [ACD/IUPAC Name]
(3S)-Spiro[indole-3,3'-pyrrolidin]-2(1H)-one [French] [ACD/IUPAC Name]
Spiro[3H-indole-3,3'-pyrrolidin]-2(1H)-one, (3S)- [ACD/Index Name]

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

091 [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: 403.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 65.5±3.0 kJ/mol
Flash Point: 183.7±28.9 °C
Index of Refraction: 1.643
Molar Refractivity: 53.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.93
ACD/LogD (pH 5.5): -2.29
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.27
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 41 Å2
Polarizability: 21.1±0.5 10-24cm3
Surface Tension: 55.0±5.0 dyne/cm
Molar Volume: 147.3±5.0 cm3

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