ChemSpider 2D Image | 5-[2-Fluoro(~2~H_4_)phenyl]-3-hydroxy-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-one | C15H6D4FN3O4

5-[2-Fluoro(2H4)phenyl]-3-hydroxy-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-one

  • Molecular FormulaC15H6D4FN3O4
  • Average mass319.281 Da
  • Monoisotopic mass319.090637 Da
  • ChemSpider ID71080923

  • Non-standard isotope - Non-standard isotope

More details:

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

2H-1,4-Benzodiazepin-2-one, 5-(6-fluorophenyl-2,3,4,5-d4)-1,3-dihydro-3-hydroxy-7-nitro- [ACD/Index Name]
5-[2-Fluor(2H4)phenyl]-3-hydroxy-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-on [German] [ACD/IUPAC Name]
5-[2-Fluoro(2H4)phenyl]-3-hydroxy-7-nitro-1,3-dihydro-2H-1,4-benzodiazepin-2-one [ACD/IUPAC Name]
5-[2-Fluoro(2H4)phényl]-3-hydroxy-7-nitro-1,3-dihydro-2H-1,4-benzodiazépin-2-one [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 551.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.6±3.0 kJ/mol
Flash Point: 287.5±30.1 °C
Index of Refraction: 1.697
Molar Refractivity: 77.4±0.5 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.20
ACD/LogD (pH 5.5): 1.37
ACD/BCF (pH 5.5): 6.48
ACD/KOC (pH 5.5): 132.58
ACD/LogD (pH 7.4): 1.37
ACD/BCF (pH 7.4): 6.47
ACD/KOC (pH 7.4): 132.48
Polar Surface Area: 108 Å2
Polarizability: 30.7±0.5 10-24cm3
Surface Tension: 63.0±7.0 dyne/cm
Molar Volume: 200.8±7.0 cm3

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