Found 2 results

Search term: LVSOPRLYYPOIMB (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (5S)-5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d][7]annulene-3,5-diol | C20H23NO2

(5S)-5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d][7]annulene-3,5-diol

  • Molecular FormulaC20H23NO2
  • Average mass309.402 Da
  • Monoisotopic mass309.172882 Da
  • ChemSpider ID114392846

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5S)-5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d][7]annulen-3,5-diol [German] [ACD/IUPAC Name]
(5S)-5-[3-(Dimethylamino)propyl]-5H-dibenzo[a,d][7]annulene-3,5-diol [ACD/IUPAC Name]
(5S)-5-[3-(Diméthylamino)propyl]-5H-dibenzo[a,d][7]annulène-3,5-diol [French] [ACD/IUPAC Name]
5H-Dibenzo[a,d]cycloheptene-3,5-diol, 5-[3-(dimethylamino)propyl]-, (5S)- [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: 494.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.3±3.0 kJ/mol
Flash Point: 259.8±27.4 °C
Index of Refraction: 1.618
Molar Refractivity: 92.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.65
ACD/LogD (pH 5.5): -0.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.81
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.87
Polar Surface Area: 44 Å2
Polarizability: 36.8±0.5 10-24cm3
Surface Tension: 52.3±3.0 dyne/cm
Molar Volume: 265.3±3.0 cm3

Click to predict properties on the Chemicalize site


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