Found 47 results

Search term: MF = 'C_{31}H_{28}N_{2}O_{6}S_{2}'
ChemSpider 2D Image | 1,4-Diazepane-1,4-diylbis{[4-(phenylsulfonyl)phenyl]methanone} | C31H28N2O6S2

1,4-Diazepane-1,4-diylbis{[4-(phenylsulfonyl)phenyl]methanone}

  • Molecular FormulaC31H28N2O6S2
  • Average mass588.694 Da
  • Monoisotopic mass588.138855 Da
  • ChemSpider ID2540815

More details:

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

1,4-Diazepan-1,4-diylbis{[4-(phenylsulfonyl)phenyl]methanon} [German] [ACD/IUPAC Name]
1,4-Diazepane-1,4-diylbis{[4-(phenylsulfonyl)phenyl]methanone} [ACD/IUPAC Name]
1,4-Diazépane-1,4-diylbis{[4-(phénylsulfonyl)phényl]méthanone} [French] [ACD/IUPAC Name]
Methanone, 1,1'-(tetrahydro-1H-1,4-diazepine-1,4(5H)-diyl)bis[1-[4-(phenylsulfonyl)phenyl]- [ACD/Index Name]

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

EU-0019025 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 837.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.1 mmHg at 25°C
Enthalpy of Vaporization: 121.8±3.0 kJ/mol
Flash Point: 460.5±34.3 °C
Index of Refraction: 1.637
Molar Refractivity: 156.9±0.4 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.18
ACD/LogD (pH 5.5): 2.67
ACD/BCF (pH 5.5): 62.79
ACD/KOC (pH 5.5): 673.79
ACD/LogD (pH 7.4): 2.67
ACD/BCF (pH 7.4): 62.79
ACD/KOC (pH 7.4): 673.79
Polar Surface Area: 126 Å2
Polarizability: 62.2±0.5 10-24cm3
Surface Tension: 55.9±3.0 dyne/cm
Molar Volume: 437.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement