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ChemSpider 2D Image | 2-[(10S)-10-Amino-5,11-dioxo-6,7,8,9,10,11-hexahydro-5H-benzo[9]annulen-6-yl]-1,3-dioxo-2-indanecarboxylic acid | C23H19NO6

2-[(10S)-10-Amino-5,11-dioxo-6,7,8,9,10,11-hexahydro-5H-benzo[9]annulen-6-yl]-1,3-dioxo-2-indanecarboxylic acid

  • Molecular FormulaC23H19NO6
  • Average mass405.400 Da
  • Monoisotopic mass405.121246 Da
  • ChemSpider ID18545619
  • defined stereocentres - 1 of 2 defined stereocentres


More details:






Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.0 g/cm3
Boiling Point: 689.4±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.0 mmHg at 25°C
Enthalpy of Vaporization: 106.1±0.0 kJ/mol
Flash Point: 370.7±0.0 °C
Index of Refraction: 1.643
Molar Refractivity: 103.4±0.0 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.66
ACD/LogD (pH 5.5): 0.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.07
ACD/LogD (pH 7.4): -0.28
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 132 Å2
Polarizability: 41.0±0.0 10-24cm3
Surface Tension: 67.8±0.0 dyne/cm
Molar Volume: 285.9±0.0 cm3

Click to predict properties on the Chemicalize site


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