Found 10 results

Search term: MF = 'C_{29}H_{28}O'
ChemSpider 2D Image | (1S,2S,E)-4-Benzylidene-2-(4-methoxyphenyl)-1-phenyl-2,4,5,6,7,7a-hexahydro-1H-indene | C29H28O

(1S,2S,E)-4-Benzylidene-2-(4-methoxyphenyl)-1-phenyl-2,4,5,6,7,7a-hexahydro-1H-indene

  • Molecular FormulaC29H28O
  • Average mass392.532 Da
  • Monoisotopic mass392.214020 Da
  • ChemSpider ID24609491

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(1S,2S,4E,7aS)-4-Benzyliden-2-(4-methoxyphenyl)-1-phenyl-2,4,5,6,7,7a-hexahydro-1H-inden [German] [ACD/IUPAC Name]
(1S,2S,4E,7aS)-4-Benzylidene-2-(4-methoxyphenyl)-1-phenyl-2,4,5,6,7,7a-hexahydro-1H-indene [ACD/IUPAC Name]
(1S,2S,4E,7aS)-4-Benzylidène-2-(4-méthoxyphényl)-1-phényl-2,4,5,6,7,7a-hexahydro-1H-indène [French] [ACD/IUPAC Name]
(1S,2S,E)-4-Benzylidene-2-(4-methoxyphenyl)-1-phenyl-2,4,5,6,7,7a-hexahydro-1H-indene
1H-Indene, 2,4,5,6,7,7a-hexahydro-2-(4-methoxyphenyl)-1-phenyl-4-(phenylmethylene)-, (1S,2S,4E,7aS)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 538.9±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 78.6±3.0 kJ/mol
Flash Point: 224.6±13.5 °C
Index of Refraction: 1.639
Molar Refractivity: 124.1±0.4 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 8.00
ACD/LogD (pH 5.5): 7.39
ACD/BCF (pH 5.5): 244037.42
ACD/KOC (pH 5.5): 249986.36
ACD/LogD (pH 7.4): 7.39
ACD/BCF (pH 7.4): 244037.42
ACD/KOC (pH 7.4): 249986.36
Polar Surface Area: 9 Å2
Polarizability: 49.2±0.5 10-24cm3
Surface Tension: 49.1±5.0 dyne/cm
Molar Volume: 345.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement