ChemSpider 2D Image | (2E)-6-Acetyl-2-(1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}ethylidene)-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione | C28H29NO8

(2E)-6-Acetyl-2-(1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}ethylidene)-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione

  • Molecular FormulaC28H29NO8
  • Average mass507.532 Da
  • Monoisotopic mass507.189331 Da
  • ChemSpider ID35146828

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-6-Acetyl-2-(1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}ethyliden)-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dion [German] [ACD/IUPAC Name]
(2E)-6-Acetyl-2-(1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}ethylidene)-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione [ACD/IUPAC Name]
(2E)-6-Acétyl-2-(1-{[2-(3,4-diméthoxyphényl)éthyl]amino}éthylidène)-7,9-dihydroxy-8,9b-diméthyldibenzo[b,d]furane-1,3(2H,9bH)-dione [French] [ACD/IUPAC Name]
1,3(2H,9bH)-Dibenzofurandione, 6-acetyl-2-[1-[[2-(3,4-dimethoxyphenyl)ethyl]amino]ethylidene]-7,9-dihydroxy-8,9b-dimethyl-, (2E)- [ACD/Index Name]
(E)-6-acetyl-2-(1-((3,4-dimethoxyphenethyl)amino)ethylidene)-7,9-dihydroxy-8,9b-dimethyldibenzo[b,d]furan-1,3(2H,9bH)-dione

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

Density: 1.4±0.1 g/cm3
Boiling Point: 739.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 111.7±3.0 kJ/mol
Flash Point: 401.0±32.9 °C
Index of Refraction: 1.644
Molar Refractivity: 132.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 4.72
ACD/LogD (pH 5.5): 4.12
ACD/BCF (pH 5.5): 786.63
ACD/KOC (pH 5.5): 4084.40
ACD/LogD (pH 7.4): 3.64
ACD/BCF (pH 7.4): 260.86
ACD/KOC (pH 7.4): 1354.45
Polar Surface Area: 131 Å2
Polarizability: 52.7±0.5 10-24cm3
Surface Tension: 66.0±5.0 dyne/cm
Molar Volume: 367.0±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement