ChemSpider 2D Image | (2E)-3,6-Dibenzyl-2-[(2,3-dimethoxy-5-quinolinyl)methylene]undecanoic acid | C37H43NO4

(2E)-3,6-Dibenzyl-2-[(2,3-dimethoxy-5-quinolinyl)methylene]undecanoic acid

  • Molecular FormulaC37H43NO4
  • Average mass565.742 Da
  • Monoisotopic mass565.319214 Da
  • ChemSpider ID8406986

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3,6-Dibenzyl-2-[(2,3-dimethoxy-5-chinolinyl)methylen]undecansäure [German] [ACD/IUPAC Name]
(2E)-3,6-Dibenzyl-2-[(2,3-dimethoxy-5-quinolinyl)methylene]undecanoic acid [ACD/IUPAC Name]
Acide (2E)-3,6-dibenzyl-2-[(2,3-diméthoxy-5-quinoléinyl)méthylène]undécanoïque [French] [ACD/IUPAC Name]
Benzeneheptanoic acid, α-[(2,3-dimethoxy-5-quinolinyl)methylene]-ε-pentyl-β-(phenylmethyl)-, (αE)- [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: 749.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 114.7±3.0 kJ/mol
Flash Point: 407.1±32.9 °C
Index of Refraction: 1.601
Molar Refractivity: 172.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 11.54
ACD/LogD (pH 5.5): 8.90
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 423954.59
ACD/LogD (pH 7.4): 7.13
ACD/BCF (pH 7.4): 28003.59
ACD/KOC (pH 7.4): 7096.79
Polar Surface Area: 69 Å2
Polarizability: 68.5±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 503.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement