ChemSpider 2D Image | 4-(1-Methyl-4-piperidinylidene)-4,10-dihydro-9H-benzo[4,5]cyclohepta[1,2-b]thiophen-9-one | C19H19NOS

4-(1-Methyl-4-piperidinylidene)-4,10-dihydro-9H-benzo[4,5]cyclohepta[1,2-b]thiophen-9-one

  • Molecular FormulaC19H19NOS
  • Average mass309.425 Da
  • Monoisotopic mass309.118744 Da
  • ChemSpider ID29787759

More details:

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

34580-09-1 [RN]
4-(1-Methyl-4-piperidinyliden)-4,10-dihydro-9H-benzo[4,5]cyclohepta[1,2-b]thiophen-9-on [German] [ACD/IUPAC Name]
4-(1-Methyl-4-piperidinylidene)-4,10-dihydro-9H-benzo[4,5]cyclohepta[1,2-b]thiophen-9-one [ACD/IUPAC Name]
4-(1-Méthyl-4-pipéridinylidène)-4,10-dihydro-9H-benzo[4,5]cyclohepta[1,2-b]thiophén-9-one [French] [ACD/IUPAC Name]
9H-Benzo[4,5]cyclohepta[1,2-b]thiophen-9-one, 4,10-dihydro-4-(1-methyl-4-piperidinylidene)- [ACD/Index Name]
10-(1-methylpiperidin-4-ylidene)-4H-benzo[1,2]cyclohepta[3,4-b]thiophen-5-one
2-(1-Methylpiperidin-4-ylidene)-6-thiatricyclo[8.4.0.03,7]tetradeca-1(14),3(7),4,10,12-pentaen-9-one
4,10-Dihydro-4-(1-methyl-4-piperidinylidene)-9H-benzo[4,5]cyclohepta[1,2-b]thiophen-9-one
9-Oxo ketotifen

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

Density: 1.2±0.1 g/cm3
Boiling Point: 488.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.5±3.0 kJ/mol
Flash Point: 249.5±28.7 °C
Index of Refraction: 1.643
Molar Refractivity: 90.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.97
ACD/LogD (pH 5.5): 1.19
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.91
ACD/LogD (pH 7.4): 2.61
ACD/BCF (pH 7.4): 24.87
ACD/KOC (pH 7.4): 130.28
Polar Surface Area: 49 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 52.0±3.0 dyne/cm
Molar Volume: 250.2±3.0 cm3

Click to predict properties on the Chemicalize site


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