ChemSpider 2D Image | 2-Methyl(3,3,4,4-~2~H_4_)-3,4,10,14b-tetrahydropyrazino[2,1-a]pyrido[2,3-c][2]benzazepin-1(2H)-one | C17H13D4N3O

2-Methyl(3,3,4,4-2H4)-3,4,10,14b-tetrahydropyrazino[2,1-a]pyrido[2,3-c][2]benzazepin-1(2H)-one

  • Molecular FormulaC17H13D4N3O
  • Average mass283.361 Da
  • Monoisotopic mass283.162262 Da
  • ChemSpider ID58783671
  • Non-standard isotope - Non-standard isotope


More details:






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

2-Methyl(3,3,4,4-2H4)-3,4,10,14b-tetrahydropyrazino[2,1-a]pyrido[2,3-c][2]benzazepin-1(2H)-on [German] [ACD/IUPAC Name]
2-Methyl(3,3,4,4-2H4)-3,4,10,14b-tetrahydropyrazino[2,1-a]pyrido[2,3-c][2]benzazepin-1(2H)-one [ACD/IUPAC Name]
2-Méthyl(3,3,4,4-2H4)-3,4,10,14b-tétrahydropyrazino[2,1-a]pyrido[2,3-c][2]benzazépin-1(2H)-one [French] [ACD/IUPAC Name]
Pyrazino[2,1-a]pyrido[2,3-c][2]benzazepin-1(2H)-one-3,4-d2, 3,4,10,14b-tetrahydro-3,4-d2-2-methyl- [ACD/Index Name]
1323255-56-6 [RN]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 515.0±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.7±3.0 kJ/mol
Flash Point: 265.3±30.1 °C
Index of Refraction: 1.681
Molar Refractivity: 80.8±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 1.59
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 21.22
ACD/KOC (pH 5.5): 282.10
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 29.39
ACD/KOC (pH 7.4): 390.76
Polar Surface Area: 36 Å2
Polarizability: 32.0±0.5 10-24cm3
Surface Tension: 65.2±5.0 dyne/cm
Molar Volume: 213.5±5.0 cm3

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