ChemSpider 2D Image | (2S)-2-(Dibutylamino)-2-[(9Z)-2,7-dichloro-9-(4-chlorobenzylidene)-9H-fluoren-4-yl]ethanol | C30H32Cl3NO

(2S)-2-(Dibutylamino)-2-[(9Z)-2,7-dichloro-9-(4-chlorobenzylidene)-9H-fluoren-4-yl]ethanol

  • Molecular FormulaC30H32Cl3NO
  • Average mass528.940 Da
  • Monoisotopic mass527.154968 Da
  • ChemSpider ID34990106

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-(Dibutylamino)-2-[(9Z)-2,7-dichlor-9-(4-chlorbenzyliden)-9H-fluoren-4-yl]ethanol [German] [ACD/IUPAC Name]
(2S)-2-(Dibutylamino)-2-[(9Z)-2,7-dichloro-9-(4-chlorobenzylidene)-9H-fluoren-4-yl]ethanol [ACD/IUPAC Name]
(2S)-2-(Dibutylamino)-2-[(9Z)-2,7-dichloro-9-(4-chlorobenzylidène)-9H-fluorén-4-yl]éthanol [French] [ACD/IUPAC Name]
9H-Fluorene-4-ethanol, 2,7-dichloro-9-[(4-chlorophenyl)methylene]-β-(dibutylamino)-, (βS,9Z)- [ACD/Index Name]
1331642-68-2 [RN]
2-(DIBUTYLAMINO)-2-(2,7-DICHLORO-9-(4-CHLOROBENZYLIDENE)-9H-FLUOREN-4-YL)ETHANOL, (RS, Z)-
UNII-E05D47583N

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

Density: 1.3±0.1 g/cm3
Boiling Point: 625.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 97.3±3.0 kJ/mol
Flash Point: 331.9±31.5 °C
Index of Refraction: 1.634
Molar Refractivity: 151.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 11.54
ACD/LogD (pH 5.5): 7.42
ACD/BCF (pH 5.5): 81861.23
ACD/KOC (pH 5.5): 29800.54
ACD/LogD (pH 7.4): 9.06
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 1324910.88
Polar Surface Area: 23 Å2
Polarizability: 59.9±0.5 10-24cm3
Surface Tension: 51.9±3.0 dyne/cm
Molar Volume: 422.3±3.0 cm3

Click to predict properties on the Chemicalize site


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