Found 9 results

Search term: MF = 'C_{31}H_{27}NO_{9}'
ChemSpider 2D Image | (5R,5aR,8aR)-8-Oxo-10-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl 1H-indole-2-carboxylate | C31H27NO9

(5R,5aR,8aR)-8-Oxo-10-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl 1H-indole-2-carboxylate

  • Molecular FormulaC31H27NO9
  • Average mass557.547 Da
  • Monoisotopic mass557.168579 Da
  • ChemSpider ID8465184

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(5R,5aR,8aR)-8-Oxo-10-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl 1H-indole-2-carboxylate [ACD/IUPAC Name]
(5R,5aR,8aR)-8-Oxo-10-(3,4,5-trimethoxyphenyl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphtho[2,3-d][1,3]dioxol-5-yl-1H-indol-2-carboxylat [German] [ACD/IUPAC Name]
1H-Indole-2-carboxylate de (5R,5aR,8aR)-8-oxo-10-(3,4,5-triméthoxyphényl)-5,5a,6,8,8a,9-hexahydrofuro[3',4':6,7]naphto[2,3-d][1,3]dioxol-5-yle [French] [ACD/IUPAC Name]
1H-Indole-2-carboxylic acid, (5R,5aR,8aR)-5,5a,6,8,8a,9-hexahydro-8-oxo-10-(3,4,5-trimethoxyphenyl)furo[3',4':6,7]naphtho[2,3-d]-1,3-dioxol-5-yl ester [ACD/Index 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: 770.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.2±3.0 kJ/mol
Flash Point: 420.0±32.9 °C
Index of Refraction: 1.690
Molar Refractivity: 144.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 4.41
ACD/LogD (pH 5.5): 4.22
ACD/BCF (pH 5.5): 942.72
ACD/KOC (pH 5.5): 4684.52
ACD/LogD (pH 7.4): 4.22
ACD/BCF (pH 7.4): 942.72
ACD/KOC (pH 7.4): 4684.52
Polar Surface Area: 115 Å2
Polarizability: 57.4±0.5 10-24cm3
Surface Tension: 72.0±5.0 dyne/cm
Molar Volume: 379.0±5.0 cm3

Click to predict properties on the Chemicalize site


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