ChemSpider 2D Image | 2,5-Dimethyl-1-[8-(methylsulfanyl)-10,11-dihydrodibenzo[b,f]thiepin-10-yl]piperazine | C21H26N2S2

2,5-Dimethyl-1-[8-(methylsulfanyl)-10,11-dihydrodibenzo[b,f]thiepin-10-yl]piperazine

  • Molecular FormulaC21H26N2S2
  • Average mass370.574 Da
  • Monoisotopic mass370.153748 Da
  • ChemSpider ID28407908

More details:

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

2,5-Dimethyl-1-[8-(methylsulfanyl)-10,11-dihydrodibenzo[b,f]thiepin-10-yl]piperazin [German] [ACD/IUPAC Name]
2,5-Dimethyl-1-[8-(methylsulfanyl)-10,11-dihydrodibenzo[b,f]thiepin-10-yl]piperazine [ACD/IUPAC Name]
2,5-Diméthyl-1-[8-(méthylsulfanyl)-10,11-dihydrodibenzo[b,f]thiépin-10-yl]pipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-[10,11-dihydro-8-(methylthio)dibenzo[b,f]thiepin-10-yl]-2,5-dimethyl- [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: 477.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.2±3.0 kJ/mol
Flash Point: 242.8±28.7 °C
Index of Refraction: 1.668
Molar Refractivity: 112.5±0.4 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 6.14
ACD/LogD (pH 5.5): 2.24
ACD/BCF (pH 5.5): 5.45
ACD/KOC (pH 5.5): 15.78
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 40.71
ACD/KOC (pH 7.4): 117.96
Polar Surface Area: 66 Å2
Polarizability: 44.6±0.5 10-24cm3
Surface Tension: 56.2±5.0 dyne/cm
Molar Volume: 302.0±5.0 cm3

Click to predict properties on the Chemicalize site


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