ChemSpider 2D Image | 3,4-Dihydro-1H-pyrido[3,4-b]azepine-2,5-dione | C9H8N2O2

3,4-Dihydro-1H-pyrido[3,4-b]azepine-2,5-dione

  • Molecular FormulaC9H8N2O2
  • Average mass176.172 Da
  • Monoisotopic mass176.058578 Da
  • ChemSpider ID24736699

More details:

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

1H-Pyrido[3,4-b]azepine-2,5-dione, 3,4-dihydro- [ACD/Index Name]
3,4-Dihydro-1H-pyrido[3,4-b]azepin-2,5-dion [German] [ACD/IUPAC Name]
3,4-Dihydro-1H-pyrido[3,4-b]azepine-2,5-dione [ACD/IUPAC Name]
3,4-Dihydro-1H-pyrido[3,4-b]azépine-2,5-dione [French] [ACD/IUPAC Name]
887576-77-4 [RN]
MFCD06656947

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

Density: 1.3±0.1 g/cm3
Boiling Point: 433.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.0±3.0 kJ/mol
Flash Point: 216.2±27.3 °C
Index of Refraction: 1.571
Molar Refractivity: 44.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.01
ACD/LogD (pH 5.5): 0.79
ACD/BCF (pH 5.5): 2.33
ACD/KOC (pH 5.5): 63.66
ACD/LogD (pH 7.4): 0.79
ACD/BCF (pH 7.4): 2.33
ACD/KOC (pH 7.4): 63.82
Polar Surface Area: 59 Å2
Polarizability: 17.7±0.5 10-24cm3
Surface Tension: 52.5±3.0 dyne/cm
Molar Volume: 136.3±3.0 cm3

Click to predict properties on the Chemicalize site


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