Found 7 results

Search term: MF = 'C_{41}H_{30}O_{2}'
ChemSpider 2D Image | (6R,7R,7aR)-7-Benzoyl-1-(diphenylmethylene)-4,6-diphenyl-1,6,7,7a-tetrahydro-5H-inden-5-one | C41H30O2

(6R,7R,7aR)-7-Benzoyl-1-(diphenylmethylene)-4,6-diphenyl-1,6,7,7a-tetrahydro-5H-inden-5-one

  • Molecular FormulaC41H30O2
  • Average mass554.676 Da
  • Monoisotopic mass554.224609 Da
  • ChemSpider ID10525950

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(6R,7R,7aR)-7-Benzoyl-1-(diphenylmethylen)-4,6-diphenyl-1,6,7,7a-tetrahydro-5H-inden-5-on [German] [ACD/IUPAC Name]
(6R,7R,7aR)-7-Benzoyl-1-(diphenylmethylene)-4,6-diphenyl-1,6,7,7a-tetrahydro-5H-inden-5-one [ACD/IUPAC Name]
(6R,7R,7aR)-7-Benzoyl-1-(diphénylméthylène)-4,6-diphényl-1,6,7,7a-tétrahydro-5H-indén-5-one [French] [ACD/IUPAC Name]
5H-Inden-5-one, 7-benzoyl-1-(diphenylmethylene)-1,6,7,7a-tetrahydro-4,6-diphenyl-, (6R,7R,7aR)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 770.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.2±3.0 kJ/mol
Flash Point: 269.9±29.9 °C
Index of Refraction: 1.702
Molar Refractivity: 171.4±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 9.87
ACD/LogD (pH 5.5): 8.97
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 1810814.75
ACD/LogD (pH 7.4): 8.97
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1810814.75
Polar Surface Area: 34 Å2
Polarizability: 68.0±0.5 10-24cm3
Surface Tension: 60.2±5.0 dyne/cm
Molar Volume: 442.6±5.0 cm3

Click to predict properties on the Chemicalize site


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