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Search term: ANIKIUAKBPWSRA (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 1-{4-[(2-Fluoro-6-methoxy-3'-nitro-3-biphenylyl)methyl]phenyl}urea | C21H18FN3O4

1-{4-[(2-Fluoro-6-methoxy-3'-nitro-3-biphenylyl)methyl]phenyl}urea

  • Molecular FormulaC21H18FN3O4
  • Average mass395.384 Da
  • Monoisotopic mass395.128143 Da
  • ChemSpider ID25056992

More details:

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

1-{4-[(2-Fluor-6-methoxy-3'-nitro-3-biphenylyl)methyl]phenyl}harnstoff [German] [ACD/IUPAC Name]
1-{4-[(2-Fluoro-6-methoxy-3'-nitro-3-biphenylyl)methyl]phenyl}urea [ACD/IUPAC Name]
1-{4-[(2-Fluoro-6-méthoxy-3'-nitro-3-biphénylyl)méthyl]phényl}urée [French] [ACD/IUPAC Name]
1-{4-[(2-fluoro-6-methoxy-3'-nitrobiphenyl-3-yl)methyl]phenyl}urea
Urea, N-[4-[(2-fluoro-6-methoxy-3'-nitro[1,1'-biphenyl]-3-yl)methyl]phenyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 517.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 79.0±3.0 kJ/mol
Flash Point: 266.8±30.1 °C
Index of Refraction: 1.644
Molar Refractivity: 106.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.33
ACD/LogD (pH 5.5): 4.32
ACD/BCF (pH 5.5): 1139.38
ACD/KOC (pH 5.5): 5364.91
ACD/LogD (pH 7.4): 4.32
ACD/BCF (pH 7.4): 1139.38
ACD/KOC (pH 7.4): 5364.89
Polar Surface Area: 110 Å2
Polarizability: 42.2±0.5 10-24cm3
Surface Tension: 55.6±3.0 dyne/cm
Molar Volume: 294.4±3.0 cm3

Click to predict properties on the Chemicalize site


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