ChemSpider 2D Image | 10-Phenyl-3,4,9,10-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-1(2H)-one | C18H16N2O

10-Phenyl-3,4,9,10-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-1(2H)-one

  • Molecular FormulaC18H16N2O
  • Average mass276.332 Da
  • Monoisotopic mass276.126251 Da
  • ChemSpider ID28611844

More details:

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

10-Phenyl-3,4,9,10-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-1(2H)-on [German] [ACD/IUPAC Name]
10-Phenyl-3,4,9,10-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-1(2H)-one [ACD/IUPAC Name]
10-Phényl-3,4,9,10-tétrahydrobenzo[b]cyclopenta[e][1,4]diazépin-1(2H)-one [French] [ACD/IUPAC Name]
1374509-72-4 [RN]
Benzo[b]cyclopenta[e][1,4]diazepin-1(2H)-one, 3,4,9,10-tetrahydro-10-phenyl- [ACD/Index Name]
10-Phenyl-2,3,9,10-tetrahydrobenzo[b]cyclopenta[e][1,4]diazepin-1(4H)-one
10-Phenyl-3,4,9,10-tetrahydro-2H-benzo[b]cyclopenta[f][1,4]diazepin-1-one
10-Phenyl-3,4,9,10-tetrahydrobenzo-[b]cyclopenta[e][1,4]diazepin-1(2H)-one
4-phenyl-2,4,5,10-tetrahydro-1H-cyclopenta[c][1,5]benzodiazepin-3-one
MFCD22374927 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 490.8±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.7±3.0 kJ/mol
    Flash Point: 189.6±28.9 °C
    Index of Refraction: 1.682
    Molar Refractivity: 82.0±0.4 cm3
    #H bond acceptors: 3
    #H bond donors: 2
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.88
    ACD/LogD (pH 5.5): 2.55
    ACD/BCF (pH 5.5): 49.92
    ACD/KOC (pH 5.5): 553.36
    ACD/LogD (pH 7.4): 2.60
    ACD/BCF (pH 7.4): 55.96
    ACD/KOC (pH 7.4): 620.20
    Polar Surface Area: 41 Å2
    Polarizability: 32.5±0.5 10-24cm3
    Surface Tension: 57.8±5.0 dyne/cm
    Molar Volume: 216.5±5.0 cm3

    Click to predict properties on the Chemicalize site


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