ChemSpider 2D Image | 8-Formyl-4-hydroxy-N-(2-hydroxyethyl)-3-[(3-isopropoxypropyl)(tetrahydro-2-furanylcarbonyl)amino]-6-methoxy-3,4,4a,9b-tetrahydrodibenzo[b,d]furan-1-carboxamide | C28H38N2O9

8-Formyl-4-hydroxy-N-(2-hydroxyethyl)-3-[(3-isopropoxypropyl)(tetrahydro-2-furanylcarbonyl)amino]-6-methoxy-3,4,4a,9b-tetrahydrodibenzo[b,d]furan-1-carboxamide

  • Molecular FormulaC28H38N2O9
  • Average mass546.609 Da
  • Monoisotopic mass546.257751 Da
  • ChemSpider ID3585182

More details:






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

1-Dibenzofurancarboxamide, 8-formyl-3,4,4a,9b-tetrahydro-4-hydroxy-N-(2-hydroxyethyl)-6-methoxy-3-[[3-(1-methylethoxy)propyl][(tetrahydro-2-furanyl)carbonyl]amino]- [ACD/Index Name]
8-Formyl-4-hydroxy-N-(2-hydroxyethyl)-3-[(3-isopropoxypropyl)(tetrahydro-2-furanylcarbonyl)amino]-6-methoxy-3,4,4a,9b-tetrahydrodibenzo[b,d]furan-1-carboxamid [German] [ACD/IUPAC Name]
8-Formyl-4-hydroxy-N-(2-hydroxyethyl)-3-[(3-isopropoxypropyl)(tetrahydro-2-furanylcarbonyl)amino]-6-methoxy-3,4,4a,9b-tetrahydrodibenzo[b,d]furan-1-carboxamide [ACD/IUPAC Name]
8-Formyl-4-hydroxy-N-(2-hydroxyéthyl)-3-[(3-isopropoxypropyl)(tétrahydro-2-furanylcarbonyl)amino]-6-méthoxy-3,4,4a,9b-tétrahydrodibenzo[b,d]furane-1-carboxamide [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 795.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 121.3±3.0 kJ/mol
Flash Point: 434.8±32.9 °C
Index of Refraction: 1.598
Molar Refractivity: 140.2±0.4 cm3
#H bond acceptors: 11
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: -0.46
ACD/LogD (pH 5.5): 0.33
ACD/BCF (pH 5.5): 1.04
ACD/KOC (pH 5.5): 35.86
ACD/LogD (pH 7.4): 0.33
ACD/BCF (pH 7.4): 1.04
ACD/KOC (pH 7.4): 35.85
Polar Surface Area: 144 Å2
Polarizability: 55.6±0.5 10-24cm3
Surface Tension: 61.9±5.0 dyne/cm
Molar Volume: 410.7±5.0 cm3

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