Found 489 results

Search term: MF = 'C_{33}H_{29}N_{3}O_{5}'
ChemSpider 2D Image | 3,3-Dimethyl-11-[5-(4-nitrophenyl)-2-furyl]-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one | C33H29N3O5

3,3-Dimethyl-11-[5-(4-nitrophenyl)-2-furyl]-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one

  • Molecular FormulaC33H29N3O5
  • Average mass547.601 Da
  • Monoisotopic mass547.210693 Da
  • ChemSpider ID2661008

More details:

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

1H-Dibenzo[b,e][1,4]diazepin-1-one, 2,3,4,5,10,11-hexahydro-3,3-dimethyl-11-[5-(4-nitrophenyl)-2-furanyl]-10-(2-phenylacetyl)- [ACD/Index Name]
3,3-Diméthyl-11-[5-(4-nitrophényl)-2-furyl]-10-(2-phénylacétyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazépin-1-one [French] [ACD/IUPAC Name]
3,3-Dimethyl-11-[5-(4-nitrophenyl)-2-furyl]-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-on [German] [ACD/IUPAC Name]
3,3-Dimethyl-11-[5-(4-nitrophenyl)-2-furyl]-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one [ACD/IUPAC Name]
3,3-dimethyl-11-[5-(4-nitrophenyl)furan-2-yl]-10-(phenylacetyl)-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
312621-41-3 [RN]
9,9-dimethyl-6-[5-(4-nitrophenyl)furan-2-yl]-5-(2-phenylacetyl)-6,8,10,11-tetrahydrobenzo[b][1,4]benzodiazepin-7-one

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 775.0±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.7 mmHg at 25°C
    Enthalpy of Vaporization: 112.8±3.0 kJ/mol
    Flash Point: 422.5±32.9 °C
    Index of Refraction: 1.686
    Molar Refractivity: 153.4±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 2
    ACD/LogP: 6.22
    ACD/LogD (pH 5.5): 6.03
    ACD/BCF (pH 5.5): 22422.85
    ACD/KOC (pH 5.5): 45269.09
    ACD/LogD (pH 7.4): 6.03
    ACD/BCF (pH 7.4): 22424.35
    ACD/KOC (pH 7.4): 45272.12
    Polar Surface Area: 108 Å2
    Polarizability: 60.8±0.5 10-24cm3
    Surface Tension: 67.2±5.0 dyne/cm
    Molar Volume: 403.4±5.0 cm3

    Click to predict properties on the Chemicalize site


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