ChemSpider 2D Image | 4-[(4-Methylphenyl)sulfonyl]-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine | C21H19NO3S

4-[(4-Methylphenyl)sulfonyl]-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine

  • Molecular FormulaC21H19NO3S
  • Average mass365.445 Da
  • Monoisotopic mass365.108551 Da
  • ChemSpider ID28418318

More details:

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

2H-1,4-Benzoxazine, 3,4-dihydro-4-[(4-methylphenyl)sulfonyl]-2-phenyl- [ACD/Index Name]
4-[(4-Methylphenyl)sulfonyl]-2-phenyl-3,4-dihydro-2H-1,4-benzoxazin [German] [ACD/IUPAC Name]
4-[(4-Methylphenyl)sulfonyl]-2-phenyl-3,4-dihydro-2H-1,4-benzoxazine [ACD/IUPAC Name]
4-[(4-Méthylphényl)sulfonyl]-2-phényl-3,4-dihydro-2H-1,4-benzoxazine [French] [ACD/IUPAC 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: 532.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 80.9±3.0 kJ/mol
Flash Point: 276.0±32.9 °C
Index of Refraction: 1.635
Molar Refractivity: 102.4±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.90
ACD/LogD (pH 5.5): 4.36
ACD/BCF (pH 5.5): 1207.72
ACD/KOC (pH 5.5): 5593.32
ACD/LogD (pH 7.4): 4.36
ACD/BCF (pH 7.4): 1207.72
ACD/KOC (pH 7.4): 5593.32
Polar Surface Area: 55 Å2
Polarizability: 40.6±0.5 10-24cm3
Surface Tension: 50.5±3.0 dyne/cm
Molar Volume: 286.1±3.0 cm3

Click to predict properties on the Chemicalize site


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