ChemSpider 2D Image | 1-[(4-Methylphenyl)sulfonyl]-6-phenyl-2,3-dihydro-1H-naphtho[2,3-b]azepine | C27H23NO2S

1-[(4-Methylphenyl)sulfonyl]-6-phenyl-2,3-dihydro-1H-naphtho[2,3-b]azepine

  • Molecular FormulaC27H23NO2S
  • Average mass425.542 Da
  • Monoisotopic mass425.144958 Da
  • ChemSpider ID30659257

More details:

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

1-[(4-Methylphenyl)sulfonyl]-6-phenyl-2,3-dihydro-1H-naphtho[2,3-b]azepin [German] [ACD/IUPAC Name]
1-[(4-Methylphenyl)sulfonyl]-6-phenyl-2,3-dihydro-1H-naphtho[2,3-b]azepine [ACD/IUPAC Name]
1-[(4-Méthylphényl)sulfonyl]-6-phényl-2,3-dihydro-1H-naphto[2,3-b]azépine [French] [ACD/IUPAC Name]
1H-Naphth[2,3-b]azepine, 2,3-dihydro-1-[(4-methylphenyl)sulfonyl]-6-phenyl- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 621.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.1±3.0 kJ/mol
Flash Point: 329.7±34.3 °C
Index of Refraction: 1.670
Molar Refractivity: 127.4±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1
ACD/LogP: 6.24
ACD/LogD (pH 5.5): 6.04
ACD/BCF (pH 5.5): 23096.84
ACD/KOC (pH 5.5): 46239.88
ACD/LogD (pH 7.4): 6.04
ACD/BCF (pH 7.4): 23096.84
ACD/KOC (pH 7.4): 46239.88
Polar Surface Area: 46 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 51.7±3.0 dyne/cm
Molar Volume: 341.3±3.0 cm3

Click to predict properties on the Chemicalize site


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