ChemSpider 2D Image | (3Z)-N,N-Dimethyl-3-(2-methyldibenzo[b,e]thiepin-11(6H)-ylidene)-1-propanamine | C20H23NS

(3Z)-N,N-Dimethyl-3-(2-methyldibenzo[b,e]thiepin-11(6H)-ylidene)-1-propanamine

  • Molecular FormulaC20H23NS
  • Average mass309.468 Da
  • Monoisotopic mass309.155121 Da
  • ChemSpider ID31005203

More details:

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

(3Z)-N,N-Dimethyl-3-(2-methyldibenzo[b,e]thiepin-11(6H)-yliden)-1-propanamin [German] [ACD/IUPAC Name]
(3Z)-N,N-Dimethyl-3-(2-methyldibenzo[b,e]thiepin-11(6H)-ylidene)-1-propanamine [ACD/IUPAC Name]
(3Z)-N,N-Diméthyl-3-(2-méthyldibenzo[b,e]thiépin-11(6H)-ylidène)-1-propanamine [French] [ACD/IUPAC Name]
1-Propanamine, N,N-dimethyl-3-(2-methyldibenzo[b,e]thiepin-11(6H)-ylidene)-, (3Z)- [ACD/Index Name]
13448-33-4 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 444.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 70.3±3.0 kJ/mol
Flash Point: 222.8±28.7 °C
Index of Refraction: 1.651
Molar Refractivity: 99.9±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.80
ACD/LogD (pH 5.5): 1.95
ACD/BCF (pH 5.5): 3.39
ACD/KOC (pH 5.5): 11.72
ACD/LogD (pH 7.4): 3.18
ACD/BCF (pH 7.4): 57.97
ACD/KOC (pH 7.4): 200.42
Polar Surface Area: 29 Å2
Polarizability: 39.6±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 273.5±3.0 cm3

Click to predict properties on the Chemicalize site


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