Found 29 results

Search term: MF = 'C_{32}H_{28}N_{2}O_{9}'
ChemSpider 2D Image | N-[(5S,5aS,8aR,9R)-8-Oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl]-5-phenyl-1,2-oxazole-3-carboxamide | C32H28N2O9

N-[(5S,5aS,8aR,9R)-8-Oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl]-5-phenyl-1,2-oxazole-3-carboxamide

  • Molecular FormulaC32H28N2O9
  • Average mass584.573 Da
  • Monoisotopic mass584.179504 Da
  • ChemSpider ID29397663

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

3-Isoxazolecarboxamide, N-[(5S,5aS,8aR,9R)-5,5a,6,8,8a,9-hexahydro-8-oxo-9-(3,4,5-trimethoxyphenyl)furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-5-yl]-5-phenyl- [ACD/Index Name]
N-[(5S,5aS,8aR,9R)-8-Oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl]-5-phenyl-1,2-oxazol-3-carboxamid [German] [ACD/IUPAC Name]
N-[(5S,5aS,8aR,9R)-8-Oxo-9-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl]-5-phenyl-1,2-oxazole-3-carboxamide [ACD/IUPAC Name]
N-[(5S,5aS,8aR,9R)-8-Oxo-9-(3,4,5-triméthoxyphényl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphto[2,3-d][1,3]dioxol-5-yl]-5-phényl-1,2-oxazole-3-carboxamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 800.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.4±3.0 kJ/mol
Flash Point: 438.1±34.3 °C
Index of Refraction: 1.670
Molar Refractivity: 150.2±0.4 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 3.11
ACD/LogD (pH 5.5): 2.94
ACD/BCF (pH 5.5): 100.41
ACD/KOC (pH 5.5): 942.91
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 100.40
ACD/KOC (pH 7.4): 942.86
Polar Surface Area: 128 Å2
Polarizability: 59.5±0.5 10-24cm3
Surface Tension: 71.2±5.0 dyne/cm
Molar Volume: 402.1±5.0 cm3

Click to predict properties on the Chemicalize site


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