ChemSpider 2D Image | (8Z)-8-Ethylidene-10-methyl-7,7a,8,9,10,11,11a,12-octahydropyrido[3',4':4,5]cyclohepta[1,2-b]indol-6(5H)-one | C19H22N2O

(8Z)-8-Ethylidene-10-methyl-7,7a,8,9,10,11,11a,12-octahydropyrido[3',4':4,5]cyclohepta[1,2-b]indol-6(5H)-one

  • Molecular FormulaC19H22N2O
  • Average mass294.391 Da
  • Monoisotopic mass294.173218 Da
  • ChemSpider ID115296397

  • Double-bond stereo - Double-bond stereo

More details:

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

(8Z)-8-Ethyliden-10-methyl-7,7a,8,9,10,11,11a,12-octahydropyrido[3',4':4,5]cyclohepta[1,2-b]indol-6(5H)-on [German] [ACD/IUPAC Name]
(8Z)-8-Ethylidene-10-methyl-7,7a,8,9,10,11,11a,12-octahydropyrido[3',4':4,5]cyclohepta[1,2-b]indol-6(5H)-one [ACD/IUPAC Name]
(8Z)-8-Éthylidène-10-méthyl-7,7a,8,9,10,11,11a,12-octahydropyrido[3',4':4,5]cyclohepta[1,2-b]indol-6(5H)-one [French] [ACD/IUPAC Name]
Pyrido[3',4':4,5]cyclohept[1,2-b]indol-6(5H)-one, 8-ethylidene-7,7a,8,9,10,11,11a,12-octahydro-10-methyl-, (8Z)- [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: 479.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.4±3.0 kJ/mol
Flash Point: 244.0±28.7 °C
Index of Refraction: 1.672
Molar Refractivity: 91.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 3.52
ACD/LogD (pH 5.5): 0.31
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.75
ACD/LogD (pH 7.4): 1.83
ACD/BCF (pH 7.4): 6.83
ACD/KOC (pH 7.4): 56.90
Polar Surface Area: 36 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 54.6±3.0 dyne/cm
Molar Volume: 243.2±3.0 cm3

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